3-(4-ethylpiperazin-1-yl)carbonyl-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 3-(4-ethylpiperazin-1-yl)carbonyl-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Openeye Name: 3-(4-ethylpiperazine-1-carbonyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one CAS Name: 3-[(4-ethyl-1-piperazinyl)-oxomethyl]-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one IUPAC Name: 3-(4-ethylpiperazine-1-carbonyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Traditional Name: 3-(4-ethylpiperazine-1-carbonyl)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2=CC3=C(C=C2)NC4=CC=CC=C4C(=O)N3

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2=CC3=C(C=C2)NC4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C20H22N4O2/c1-2-23-9-11-24(12-10-23)20(26)14-7-8-17-18(13-14)22-19(25)15-5-3-4-6-16(15)21-17/h3-8,13,21H,2,9-12H2,1H3,(H,22,25)