N-[4-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]-6-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[4-[3-(azepan-1-yl)-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]-6-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: N-[4-[3-(azepan-1-yl)-3-oxo-propyl]thiazol-2-yl]-6-oxo-1H-pyridine-3-carboxamide CAS Name: N-[4-[3-(1-azepanyl)-3-oxopropyl]-2-thiazolyl]-6-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-[4-[3-(azepan-1-yl)-3-oxopropyl]-1,3-thiazol-2-yl]-6-oxo-1H-pyridine-3-carboxamide Traditional Name: N-[4-[3-(azepan-1-yl)-3-keto-propyl]thiazol-2-yl]-6-keto-1H-pyridine-3-carboxamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CCC2=CSC(=N2)NC(=O)C3=CNC(=O)C=C3

Isomeric SMILES

C1CCCN(CC1)C(=O)CCC2=CSC(=N2)NC(=O)C3=CNC(=O)C=C3

InChI

InChI=1S/C18H22N4O3S/c23-15-7-5-13(11-19-15)17(25)21-18-20-14(12-26-18)6-8-16(24)22-9-3-1-2-4-10-22/h5,7,11-12H,1-4,6,8-10H2,(H,19,23)(H,20,21,25)