1-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-phenyl-thiourea

Systemtic Name: 1-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-phenyl-thiourea Openeye Name: 1-[3-(4-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-3-phenyl-thiourea CAS Name: 1-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-phenylthiourea IUPAC Name: 1-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-phenylthiourea Traditional Name: 1-[3-(4-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-3-phenyl-thiourea Formula: C15H12ClN5S2 MolecularWeight: 361.87228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NN2C(=NNC2=S)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NN2C(=NNC2=S)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClN5S2/c16-11-8-6-10(7-9-11)13-18-19-15(23)21(13)20-14(22)17-12-4-2-1-3-5-12/h1-9H,(H,19,23)(H2,17,20,22)