N-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-4-oxidanylidene-4-(6-oxidanylidene-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanamide

Systemtic Name: N-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-4-oxidanylidene-4-(6-oxidanylidene-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanamide Openeye Name: N-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-4-oxo-4-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanamide CAS Name: N-ethyl-N-[2-(4-methyl-1-piperazinyl)ethyl]-4-oxo-4-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanamide IUPAC Name: N-ethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-4-oxo-4-(6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)butanamide Traditional Name: N-ethyl-4-keto-4-(6-keto-5H-pyrido[2,3-b][1,4]benzodiazepin-11-yl)-N-[2-(4-methylpiperazino)ethyl]butyramide Formula: C25H32N6O3 MolecularWeight: 464.55998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N6O3/c1-3-30(18-17-29-15-13-28(2)14-16-29)22(32)10-11-23(33)31-21-9-5-4-7-19(21)25(34)27-20-8-6-12-26-24(20)31/h4-9,12H,3,10-11,13-18H2,1-2H3,(H,27,34)