N-[2-methoxy-4-[4-(thiophen-3-ylcarbonylamino)butanoylamino]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[2-methoxy-4-[4-(thiophen-3-ylcarbonylamino)butanoylamino]phenyl]pyridine-3-carboxamide Openeye Name: N-[2-methoxy-4-[4-(thiophene-3-carbonylamino)butanoylamino]phenyl]pyridine-3-carboxamide CAS Name: N-[2-methoxy-4-[[1-oxo-4-[[oxo(3-thiophenyl)methyl]amino]butyl]amino]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[2-methoxy-4-[4-(thiophene-3-carbonylamino)butanoylamino]phenyl]pyridine-3-carboxamide Traditional Name: N-[2-methoxy-4-[4-(3-thenoylamino)butanoylamino]phenyl]nicotinamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CCCNC(=O)C2=CSC=C2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CCCNC(=O)C2=CSC=C2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C22H22N4O4S/c1-30-19-12-17(6-7-18(19)26-22(29)15-4-2-9-23-13-15)25-20(27)5-3-10-24-21(28)16-8-11-31-14-16/h2,4,6-9,11-14H,3,5,10H2,1H3,(H,24,28)(H,25,27)(H,26,29)