N-[2-[2-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-3,4-diethoxy-benzamide

Systemtic Name: N-[2-[2-[(3-chloranyl-2-methyl-phenyl)carbamothioyl]hydrazinyl]-2-oxidanylidene-ethyl]-3,4-diethoxy-benzamide Openeye Name: N-[2-[2-[(3-chloro-2-methyl-phenyl)carbamothioyl]hydrazino]-2-oxo-ethyl]-3,4-diethoxy-benzamide CAS Name: N-[2-[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]hydrazo]-2-oxoethyl]-3,4-diethoxybenzamide IUPAC Name: N-[2-[2-[(3-chloro-2-methylphenyl)carbamothioyl]hydrazinyl]-2-oxoethyl]-3,4-diethoxybenzamide Traditional Name: N-[2-[N'-[(3-chloro-2-methyl-phenyl)thiocarbamoyl]hydrazino]-2-keto-ethyl]-3,4-diethoxy-benzamide Formula: C21H25ClN4O4S MolecularWeight: 464.9656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)NNC(=S)NC2=C(C(=CC=C2)Cl)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCC(=O)NNC(=S)NC2=C(C(=CC=C2)Cl)C)OCC

InChI

InChI=1S/C21H25ClN4O4S/c1-4-29-17-10-9-14(11-18(17)30-5-2)20(28)23-12-19(27)25-26-21(31)24-16-8-6-7-15(22)13(16)3/h6-11H,4-5,12H2,1-3H3,(H,23,28)(H,25,27)(H2,24,26,31)