4-(8-cyclopropyl-2-oxidanylidene-1,3-dihydro-1,5-benzodiazepin-4-yl)pyridine-2-carbonitrile

Systemtic Name: 4-(8-cyclopropyl-2-oxidanylidene-1,3-dihydro-1,5-benzodiazepin-4-yl)pyridine-2-carbonitrile Openeye Name: 4-(8-cyclopropyl-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl)pyridine-2-carbonitrile CAS Name: 4-(8-cyclopropyl-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl)-2-pyridinecarbonitrile IUPAC Name: 4-(8-cyclopropyl-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl)pyridine-2-carbonitrile Traditional Name: 4-(8-cyclopropyl-2-keto-1,3-dihydro-1,5-benzodiazepin-4-yl)picolinonitrile Formula: C18H14N4O MolecularWeight: 302.32996

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC3=C(C=C2)N=C(CC(=O)N3)C4=CC(=NC=C4)C#N

Isomeric SMILES

C1CC1C2=CC3=C(C=C2)N=C(CC(=O)N3)C4=CC(=NC=C4)C#N

InChI

InChI=1S/C18H14N4O/c19-10-14-7-13(5-6-20-14)16-9-18(23)22-17-8-12(11-1-2-11)3-4-15(17)21-16/h3-8,11H,1-2,9H2,(H,22,23)