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

Systemtic Name: 3-(2-methoxyphenyl)-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one Openeye Name: 3-(2-methoxyphenyl)-1-[3-phenyl-5-(2-thienylmethylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one CAS Name: 3-(2-methoxyphenyl)-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-2-propen-1-one IUPAC Name: 3-(2-methoxyphenyl)-1-[3-phenyl-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one Traditional Name: 3-(2-methoxyphenyl)-1-[3-phenyl-5-(2-thenylamino)-1,2,4-triazol-1-yl]prop-2-en-1-one Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1C=CC(=O)N2C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CS4

InChI

InChI=1S/C23H20N4O2S/c1-29-20-12-6-5-8-17(20)13-14-21(28)27-23(24-16-19-11-7-15-30-19)25-22(26-27)18-9-3-2-4-10-18/h2-15H,16H2,1H3,(H,24,25,26)