AC1O1NDU structure

AC1O1NDU

(E)-N-[[(4-methoxybenzoyl)amino]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide

Also Known As: N-{[2-(4-methoxybenzoyl)hydrazino]carbonothioyl}-3-(1-naphthyl)acrylamide|(E)-N-[[(4-methoxybenzoyl)amino]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide|N-[[(4-methoxybenzoyl)amino]thiocarbamoyl]-3-naphthalen-1-yl-prop-2-enamide|(2E)-N-({2-[(4-methoxyphenyl)carbonyl]hydrazinyl}carbonothioyl)-3-(naphthalen-1-yl)prop-2-enamide|benzoic acid, 4-methoxy-, 2-[[[(2E)-3-(1-naphthalenyl)-1-oxo-2-propenyl]amino]thioxomethyl]hydrazide

CAS: 649575-54-2
Molecular Formula C22H19N3O3S
Molecular Weight 405.11472 g/mol
LogP 3.1973
Topological Polar Surface Area 79.46 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 405.11472
Monoisotopic Mass 405.11472
Heavy Atoms 29
Complexity 1072.8624

Chemical Identifiers

CAS Number 649575-54-2
SMILES COC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC=CC3=CC=CC=C32

Product Overview

AC1O1NDU (CAS 649575-54-2), with molecular formula C22H19N3O3S and molecular weight 405.11472 g/mol. IUPAC: (E)-N-[[(4-methoxybenzoyl)amino]carbamothioyl]-3-naphthalen-1-ylprop-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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