N-(2-methylphenyl)-3-oxidanylidene-3-(5-phenothiazin-10-yl-3-phenyl-3,4-dihydropyrazol-2-yl)propanamide

Systemtic Name: N-(2-methylphenyl)-3-oxidanylidene-3-(5-phenothiazin-10-yl-3-phenyl-3,4-dihydropyrazol-2-yl)propanamide Openeye Name: N-(o-tolyl)-3-oxo-3-(5-phenothiazin-10-yl-3-phenyl-3,4-dihydropyrazol-2-yl)propanamide CAS Name: N-(2-methylphenyl)-3-oxo-3-[5-(10-phenothiazinyl)-3-phenyl-3,4-dihydropyrazol-2-yl]propanamide IUPAC Name: N-(2-methylphenyl)-3-oxo-3-(5-phenothiazin-10-yl-3-phenyl-3,4-dihydropyrazol-2-yl)propanamide Traditional Name: 3-keto-N-(o-tolyl)-3-(3-phenothiazin-10-yl-5-phenyl-2-pyrazolin-1-yl)propionamide Formula: C31H26N4O2S MolecularWeight: 518.62874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CC(=O)N2C(CC(=N2)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CC(=O)N2C(CC(=N2)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

InChI

InChI=1S/C31H26N4O2S/c1-21-11-5-6-14-23(21)32-30(36)20-31(37)35-26(22-12-3-2-4-13-22)19-29(33-35)34-24-15-7-9-17-27(24)38-28-18-10-8-16-25(28)34/h2-18,26H,19-20H2,1H3,(H,32,36)