2-cyano-3-[4-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]pyrido[1,2-a]pyrimidin-3-yl]-N-prop-2-enyl-prop-2-enamide

Systemtic Name: 2-cyano-3-[4-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]pyrido[1,2-a]pyrimidin-3-yl]-N-prop-2-enyl-prop-2-enamide Openeye Name: N-allyl-3-[2-(4-benzylpiperazin-1-yl)-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-prop-2-enamide CAS Name: 2-cyano-3-[4-oxo-2-[4-(phenylmethyl)-1-piperazinyl]-3-pyrido[1,2-a]pyrimidinyl]-N-prop-2-enyl-2-propenamide IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-prop-2-enylprop-2-enamide Traditional Name: N-allyl-3-[2-(4-benzylpiperazino)-4-keto-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-acrylamide Formula: C26H26N6O2 MolecularWeight: 454.52364

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(=CC1=C(N=C2C=CC=CN2C1=O)N3CCN(CC3)CC4=CC=CC=C4)C#N

Isomeric SMILES

C=CCNC(=O)C(=CC1=C(N=C2C=CC=CN2C1=O)N3CCN(CC3)CC4=CC=CC=C4)C#N

InChI

InChI=1S/C26H26N6O2/c1-2-11-28-25(33)21(18-27)17-22-24(29-23-10-6-7-12-32(23)26(22)34)31-15-13-30(14-16-31)19-20-8-4-3-5-9-20/h2-10,12,17H,1,11,13-16,19H2,(H,28,33)