S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] 4-chloranylbenzenecarbothioate

Systemtic Name: S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] 4-chloranylbenzenecarbothioate Openeye Name: S-[(E)-N'-(isopropylideneamino)carbamimidoyl] 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-[(E)-amino-(propan-2-ylidenehydrazinylidene)methyl] ester IUPAC Name: S-[(E)-N'-(propan-2-ylideneamino)carbamimidoyl] 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-[(E)-N'-(isopropylideneamino)amidino] ester Formula: C11H12ClN3OS MolecularWeight: 269.75048

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C(N)SC(=O)C1=CC=C(C=C1)Cl)C

Isomeric SMILES

CC(=N/N=C(\N)/SC(=O)C1=CC=C(C=C1)Cl)C

InChI

InChI=1S/C11H12ClN3OS/c1-7(2)14-15-11(13)17-10(16)8-3-5-9(12)6-4-8/h3-6H,1-2H3,(H2,13,15)