N-[2-(azepan-1-yl)ethyl]-3-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]propanamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-3-[3-(4-chlorophenyl)-6-oxidanylidene-pyridazin-1-yl]propanamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-3-[3-(4-chlorophenyl)-6-oxo-pyridazin-1-yl]propanamide CAS Name: N-[2-(1-azepanyl)ethyl]-3-[3-(4-chlorophenyl)-6-oxo-1-pyridazinyl]propanamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-3-[3-(4-chlorophenyl)-6-oxopyridazin-1-yl]propanamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-3-[3-(4-chlorophenyl)-6-keto-pyridazin-1-yl]propionamide Formula: C21H27ClN4O2 MolecularWeight: 402.91768

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNC(=O)CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)CCNC(=O)CCN2C(=O)C=CC(=N2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H27ClN4O2/c22-18-7-5-17(6-8-18)19-9-10-21(28)26(24-19)15-11-20(27)23-12-16-25-13-3-1-2-4-14-25/h5-10H,1-4,11-16H2,(H,23,27)