11-(7-piperidin-1-ylhept-3-yn-2-yl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Systemtic Name: 11-(7-piperidin-1-ylhept-3-yn-2-yl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Openeye Name: 11-[1-methyl-6-(1-piperidyl)hex-2-ynyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one CAS Name: 11-[7-(1-piperidinyl)hept-3-yn-2-yl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one IUPAC Name: 11-(7-piperidin-1-ylhept-3-yn-2-yl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Traditional Name: 11-(1-methyl-6-piperidino-hex-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#CCCCN1CCCCC1)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

Isomeric SMILES

CC(C#CCCCN1CCCCC1)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

InChI

InChI=1S/C24H28N4O/c1-19(11-4-2-7-16-27-17-8-3-9-18-27)28-22-14-6-5-12-20(22)24(29)26-21-13-10-15-25-23(21)28/h5-6,10,12-15,19H,2-3,7-9,16-18H2,1H3,(H,26,29)