1-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethylamino]-3-phenyl-thiourea

Systemtic Name: 1-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethylamino]-3-phenyl-thiourea Openeye Name: 1-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethylamino]-3-phenyl-thiourea CAS Name: 1-[[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]methylamino]-3-phenylthiourea IUPAC Name: 1-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanylmethylamino]-3-phenylthiourea Traditional Name: 1-[[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]methylamino]-3-phenyl-thiourea Formula: C22H20N6S2 MolecularWeight: 432.5644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCNNC(=S)NC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCNNC(=S)NC4=CC=CC=C4

InChI

InChI=1S/C22H20N6S2/c29-21(24-18-12-6-2-7-13-18)26-23-16-30-22-27-25-20(17-10-4-1-5-11-17)28(22)19-14-8-3-9-15-19/h1-15,23H,16H2,(H2,24,26,29)