N-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)phenyl]-1-phenyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide CAS Name: N-[4-(2-amino-2-oxoethyl)phenyl]-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)phenyl]-1-phenyl-5-thiophen-2-yl-1,2,4-triazole-3-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)phenyl]-1-phenyl-5-(2-thienyl)-1,2,4-triazole-3-carboxamide Formula: C21H17N5O2S MolecularWeight: 403.45698

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC(=N2)C(=O)NC3=CC=C(C=C3)CC(=O)N)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC(=N2)C(=O)NC3=CC=C(C=C3)CC(=O)N)C4=CC=CS4

InChI

InChI=1S/C21H17N5O2S/c22-18(27)13-14-8-10-15(11-9-14)23-21(28)19-24-20(17-7-4-12-29-17)26(25-19)16-5-2-1-3-6-16/h1-12H,13H2,(H2,22,27)(H,23,28)