3-(2-chlorophenyl)-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one

Systemtic Name: 3-(2-chlorophenyl)-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one Openeye Name: 3-(2-chlorophenyl)-1-[3-phenyl-5-(2-thienylmethylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one CAS Name: 3-(2-chlorophenyl)-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-2-propen-1-one IUPAC Name: 3-(2-chlorophenyl)-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one Traditional Name: 3-(2-chlorophenyl)-1-[3-phenyl-5-(2-thenylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one Formula: C22H17ClN4OS MolecularWeight: 420.91458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CS3)C(=O)C=CC4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CS3)C(=O)C=CC4=CC=CC=C4Cl

InChI

InChI=1S/C22H17ClN4OS/c23-19-11-5-4-7-16(19)12-13-20(28)27-22(24-15-18-10-6-14-29-18)25-21(26-27)17-8-2-1-3-9-17/h1-14H,15H2,(H,24,25,26)