11-(4-piperidin-1-ylbut-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Systemtic Name: 11-(4-piperidin-1-ylbut-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Openeye Name: 11-[4-(1-piperidyl)but-2-ynyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one CAS Name: 11-[4-(1-piperidinyl)but-2-ynyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one IUPAC Name: 11-(4-piperidin-1-ylbut-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Traditional Name: 11-(4-piperidinobut-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC#CCN2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

Isomeric SMILES

C1CCN(CC1)CC#CCN2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

InChI

InChI=1S/C21H22N4O/c26-21-17-9-2-3-11-19(17)25(20-18(23-21)10-8-12-22-20)16-7-6-15-24-13-4-1-5-14-24/h2-3,8-12H,1,4-5,13-16H2,(H,23,26)