N-cyclopentyl-4-(6-oxidanylidene-1-phenyl-pyridazin-3-yl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-cyclopentyl-4-(6-oxidanylidene-1-phenyl-pyridazin-3-yl)-1,4-diazepane-1-carboxamide Openeye Name: N-cyclopentyl-4-(6-oxo-1-phenyl-pyridazin-3-yl)-1,4-diazepane-1-carboxamide CAS Name: N-cyclopentyl-4-(6-oxo-1-phenyl-3-pyridazinyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-cyclopentyl-4-(6-oxo-1-phenylpyridazin-3-yl)-1,4-diazepane-1-carboxamide Traditional Name: N-cyclopentyl-4-(6-keto-1-phenyl-pyridazin-3-yl)-1,4-diazepane-1-carboxamide Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)N2CCCN(CC2)C3=NN(C(=O)C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=O)N2CCCN(CC2)C3=NN(C(=O)C=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N5O2/c27-20-12-11-19(23-26(20)18-9-2-1-3-10-18)24-13-6-14-25(16-15-24)21(28)22-17-7-4-5-8-17/h1-3,9-12,17H,4-8,13-16H2,(H,22,28)