4-[8-chloranyl-7-[cyclopropyl(methyl)amino]-2-oxidanylidene-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile

Systemtic Name: 4-[8-chloranyl-7-[cyclopropyl(methyl)amino]-2-oxidanylidene-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Openeye Name: 4-[8-chloro-7-[cyclopropyl(methyl)amino]-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile CAS Name: 4-[8-chloro-7-[cyclopropyl(methyl)amino]-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl]-2-pyridinecarbonitrile IUPAC Name: 4-[8-chloro-7-[cyclopropyl(methyl)amino]-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl]pyridine-2-carbonitrile Traditional Name: 4-[8-chloro-7-[cyclopropyl(methyl)amino]-2-keto-1,3-dihydro-1,5-benzodiazepin-4-yl]picolinonitrile Formula: C19H16ClN5O MolecularWeight: 365.81624

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CC1)C2=C(C=C3C(=C2)N=C(CC(=O)N3)C4=CC(=NC=C4)C#N)Cl

Isomeric SMILES

CN(C1CC1)C2=C(C=C3C(=C2)N=C(CC(=O)N3)C4=CC(=NC=C4)C#N)Cl

InChI

InChI=1S/C19H16ClN5O/c1-25(13-2-3-13)18-8-17-16(7-14(18)20)24-19(26)9-15(23-17)11-4-5-22-12(6-11)10-21/h4-8,13H,2-3,9H2,1H3,(H,24,26)