AC1NUF7W structure

AC1NUF7W

(E)-N-[[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide

Also Known As: (2E)-N-{[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl}-3-(furan-2-yl)prop-2-enamide|(E)-N-((3-(benzo[d]oxazol-2-yl)-4-hydroxyphenyl)carbamothioyl)-3-(furan-2-yl)acrylamide|(2E)-N-{[(3-benzoxazol-2-yl-4-hydroxyphenyl)amino]thioxomethyl}-3-(2-furyl)pro p-2-enamide|(E)-N-[[(3E)-3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide|(E)-N-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide

CAS: 401615-34-7
Molecular Formula C21H15N3O4S
Molecular Weight 405.07834 g/mol
LogP 4.3198
Topological Polar Surface Area 100.53 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 6
Rotatable Bonds 4
Exact Mass 405.07834
Monoisotopic Mass 405.07834
Heavy Atoms 29
Complexity 1178.8871

Chemical Identifiers

CAS Number 401615-34-7
SMILES C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)NC(=S)NC(=O)/C=C/C4=CC=CO4)O

Product Overview

AC1NUF7W (CAS 401615-34-7), with molecular formula C21H15N3O4S and molecular weight 405.07834 g/mol. IUPAC: (E)-N-[[3-(1,3-benzoxazol-2-yl)-4-hydroxyphenyl]carbamothioyl]-3-(furan-2-yl)prop-2-enamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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