11-[2-(4-prop-2-ynylpiperazin-1-yl)ethanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one

Systemtic Name: 11-[2-(4-prop-2-ynylpiperazin-1-yl)ethanoyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Openeye Name: 11-[2-(4-prop-2-ynylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one CAS Name: 11-[1-oxo-2-(4-prop-2-ynyl-1-piperazinyl)ethyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one IUPAC Name: 11-[2-(4-prop-2-ynylpiperazin-1-yl)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Traditional Name: 11-[2-(4-propargylpiperazino)acetyl]-5H-pyrido[2,3-b][1,4]benzodiazepin-6-one Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

Isomeric SMILES

C#CCN1CCN(CC1)CC(=O)N2C3=CC=CC=C3C(=O)NC4=C2N=CC=C4

InChI

InChI=1S/C21H21N5O2/c1-2-10-24-11-13-25(14-12-24)15-19(27)26-18-8-4-3-6-16(18)21(28)23-17-7-5-9-22-20(17)26/h1,3-9H,10-15H2,(H,23,28)