(3-phenyl-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl)-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: (3-phenyl-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl)-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [3-phenyl-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: (3-phenyl-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl)-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: (3-phenyl-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl)-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [5-phenyl-3-(2-thienyl)-2-pyrazolin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C23H22N2O4S/c1-27-19-12-16(13-20(28-2)22(19)29-3)23(26)25-18(15-8-5-4-6-9-15)14-17(24-25)21-10-7-11-30-21/h4-13,18H,14H2,1-3H3