S-[2-[(4-methylphenyl)carbamoyl]hydrazinyl] 2-[5-(3,4-dimethoxyphenyl)-1,2,3,4-tetrazol-2-yl]ethanethioate

Systemtic Name: S-[2-[(4-methylphenyl)carbamoyl]hydrazinyl] 2-[5-(3,4-dimethoxyphenyl)-1,2,3,4-tetrazol-2-yl]ethanethioate Openeye Name: S-[2-(p-tolylcarbamoyl)hydrazino] 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]ethanethioate CAS Name: 2-[5-(3,4-dimethoxyphenyl)-2-tetrazolyl]ethanethioic acid S-[[(4-methylanilino)-oxomethyl]hydrazo] ester IUPAC Name: S-[2-[(4-methylphenyl)carbamoyl]hydrazinyl] 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]ethanethioate Traditional Name: 2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]ethanethioic acid S-[N'-(p-tolylcarbamoyl)hydrazino] ester Formula: C19H21N7O4S MolecularWeight: 443.47954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NNSC(=O)CN2N=C(N=N2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NNSC(=O)CN2N=C(N=N2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C19H21N7O4S/c1-12-4-7-14(8-5-12)20-19(28)22-25-31-17(27)11-26-23-18(21-24-26)13-6-9-15(29-2)16(10-13)30-3/h4-10,25H,11H2,1-3H3,(H2,20,22,28)