N-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-phenothiazin-10-yl-propanamide

Systemtic Name: N-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-3-phenothiazin-10-yl-propanamide Openeye Name: N-[2-(2,5-dimethylanilino)-2-oxo-ethyl]-N-methyl-3-phenothiazin-10-yl-propanamide CAS Name: N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methyl-3-(10-phenothiazinyl)propanamide IUPAC Name: N-[2-(2,5-dimethylanilino)-2-oxoethyl]-N-methyl-3-phenothiazin-10-ylpropanamide Traditional Name: N-[2-(2,5-dimethylanilino)-2-keto-ethyl]-N-methyl-3-phenothiazin-10-yl-propionamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CN(C)C(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C26H27N3O2S/c1-18-12-13-19(2)20(16-18)27-25(30)17-28(3)26(31)14-15-29-21-8-4-6-10-23(21)32-24-11-7-5-9-22(24)29/h4-13,16H,14-15,17H2,1-3H3,(H,27,30)