N-[2-methoxy-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]pyridine-3-carboxamide

Systemtic Name: N-[2-methoxy-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]pyridine-3-carboxamide Openeye Name: N-[2-methoxy-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]pyridine-3-carboxamide CAS Name: N-[2-methoxy-4-[[1-oxo-3-(10-phenothiazinyl)propyl]amino]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[2-methoxy-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]pyridine-3-carboxamide Traditional Name: N-[2-methoxy-4-(3-phenothiazin-10-ylpropanoylamino)phenyl]nicotinamide Formula: C28H24N4O3S MolecularWeight: 496.58016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42)NC(=O)C5=CN=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CCN2C3=CC=CC=C3SC4=CC=CC=C42)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C28H24N4O3S/c1-35-24-17-20(12-13-21(24)31-28(34)19-7-6-15-29-18-19)30-27(33)14-16-32-22-8-2-4-10-25(22)36-26-11-5-3-9-23(26)32/h2-13,15,17-18H,14,16H2,1H3,(H,30,33)(H,31,34)