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

Systemtic Name: N-(3-methoxyphenyl)-3-oxidanylidene-3-(5-phenothiazin-10-yl-3-phenyl-3,4-dihydropyrazol-2-yl)propanamide Openeye Name: N-(3-methoxyphenyl)-3-oxo-3-(5-phenothiazin-10-yl-3-phenyl-3,4-dihydropyrazol-2-yl)propanamide CAS Name: N-(3-methoxyphenyl)-3-oxo-3-[5-(10-phenothiazinyl)-3-phenyl-3,4-dihydropyrazol-2-yl]propanamide IUPAC Name: N-(3-methoxyphenyl)-3-oxo-3-(5-phenothiazin-10-yl-3-phenyl-3,4-dihydropyrazol-2-yl)propanamide Traditional Name: 3-keto-N-(3-methoxyphenyl)-3-(3-phenothiazin-10-yl-5-phenyl-2-pyrazolin-1-yl)propionamide Formula: C31H26N4O3S MolecularWeight: 534.62814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CC(=O)N2C(CC(=N2)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CC(=O)N2C(CC(=N2)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

InChI

InChI=1S/C31H26N4O3S/c1-38-23-13-9-12-22(18-23)32-30(36)20-31(37)35-26(21-10-3-2-4-11-21)19-29(33-35)34-24-14-5-7-16-27(24)39-28-17-8-6-15-25(28)34/h2-18,26H,19-20H2,1H3,(H,32,36)