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

Systemtic Name: 11-(4-pyrrolidin-1-ylbut-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Openeye Name: 11-(4-pyrrolidin-1-ylbut-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one CAS Name: 11-[4-(1-pyrrolidinyl)but-2-ynyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one IUPAC Name: 11-(4-pyrrolidin-1-ylbut-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Traditional Name: 11-(4-pyrrolidinobut-2-ynyl)-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Formula: C20H20N4O MolecularWeight: 332.399

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC#CCN2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

Isomeric SMILES

C1CCN(C1)CC#CCN2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

InChI

InChI=1S/C20H20N4O/c25-20-16-8-1-2-10-18(16)24(19-17(22-20)9-7-11-21-19)15-6-5-14-23-12-3-4-13-23/h1-2,7-11H,3-4,12-15H2,(H,22,25)