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

Systemtic Name: 1-[3-[(4-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-phenyl-thiourea Openeye Name: 1-[3-[(4-methoxyphenyl)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]-3-phenyl-thiourea CAS Name: 1-[3-[(4-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-phenylthiourea IUPAC Name: 1-[3-[(4-methoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-phenylthiourea Traditional Name: 1-(3-p-anisyl-5-thioxo-1H-1,2,4-triazol-4-yl)-3-phenyl-thiourea Formula: C17H17N5OS2 MolecularWeight: 371.47978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NNC(=S)N2NC(=S)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NNC(=S)N2NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C17H17N5OS2/c1-23-14-9-7-12(8-10-14)11-15-19-20-17(25)22(15)21-16(24)18-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,20,25)(H2,18,21,24)