3-[[5-(2-chlorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: 3-[[5-(2-chlorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 3-[[4-benzyl-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 3-[[5-(2-chlorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 3-[[4-benzyl-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: 3-[[4-benzyl-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C18H17ClN4OS MolecularWeight: 372.87178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCCC(=O)N)C3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCCC(=O)N)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H17ClN4OS/c19-15-9-5-4-8-14(15)17-21-22-18(25-11-10-16(20)24)23(17)12-13-6-2-1-3-7-13/h1-9H,10-12H2,(H2,20,24)