4-[4-methyl-7-oxidanylidene-2-(prop-2-enylamino)pyrido[2,3-d]pyrimidin-8-yl]-N-octyl-benzamide

Systemtic Name: 4-[4-methyl-7-oxidanylidene-2-(prop-2-enylamino)pyrido[2,3-d]pyrimidin-8-yl]-N-octyl-benzamide Openeye Name: 4-[2-(allylamino)-4-methyl-7-oxo-pyrido[2,3-d]pyrimidin-8-yl]-N-octyl-benzamide CAS Name: 4-[4-methyl-7-oxo-2-(prop-2-enylamino)-8-pyrido[2,3-d]pyrimidinyl]-N-octylbenzamide IUPAC Name: 4-[4-methyl-7-oxo-2-(prop-2-enylamino)pyrido[2,3-d]pyrimidin-8-yl]-N-octylbenzamide Traditional Name: 4-[2-(allylamino)-7-keto-4-methyl-pyrido[2,3-d]pyrimidin-8-yl]-N-octyl-benzamide Formula: C26H33N5O2 MolecularWeight: 447.57252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=CC=C(C=C1)N2C(=O)C=CC3=C(N=C(N=C32)NCC=C)C

Isomeric SMILES

CCCCCCCCNC(=O)C1=CC=C(C=C1)N2C(=O)C=CC3=C(N=C(N=C32)NCC=C)C

InChI

InChI=1S/C26H33N5O2/c1-4-6-7-8-9-10-18-27-25(33)20-11-13-21(14-12-20)31-23(32)16-15-22-19(3)29-26(28-17-5-2)30-24(22)31/h5,11-16H,2,4,6-10,17-18H2,1,3H3,(H,27,33)(H,28,29,30)