N-[4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-2-methoxy-phenyl]pyridine-3-carboxamide CAS Name: N-[4-[[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]amino]-2-methoxyphenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-2-methoxyphenyl]pyridine-3-carboxamide Traditional Name: N-[4-[4-(1,3-benzothiazol-2-yl)butanoylamino]-2-methoxy-phenyl]nicotinamide Formula: C24H22N4O3S MolecularWeight: 446.52148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2)NC(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2)NC(=O)C4=CN=CC=C4

InChI

InChI=1S/C24H22N4O3S/c1-31-20-14-17(11-12-18(20)28-24(30)16-6-5-13-25-15-16)26-22(29)9-4-10-23-27-19-7-2-3-8-21(19)32-23/h2-3,5-8,11-15H,4,9-10H2,1H3,(H,26,29)(H,28,30)