8-ethyl-4-methyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]-6-thiophen-2-yl-pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-ethyl-4-methyl-2-[[4-(4-methylpiperazin-1-yl)phenyl]amino]-6-thiophen-2-yl-pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-ethyl-4-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]-6-(2-thienyl)pyrido[2,3-d]pyrimidin-7-one CAS Name: 8-ethyl-4-methyl-2-[4-(4-methyl-1-piperazinyl)anilino]-6-thiophen-2-yl-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 8-ethyl-4-methyl-2-[4-(4-methylpiperazin-1-yl)anilino]-6-thiophen-2-ylpyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-ethyl-4-methyl-2-[4-(4-methylpiperazino)anilino]-6-(2-thienyl)pyrido[2,3-d]pyrimidin-7-one Formula: C25H28N6OS MolecularWeight: 460.59442

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=NC(=C2C=C(C1=O)C3=CC=CS3)C)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CCN1C2=NC(=NC(=C2C=C(C1=O)C3=CC=CS3)C)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C25H28N6OS/c1-4-31-23-20(16-21(24(31)32)22-6-5-15-33-22)17(2)26-25(28-23)27-18-7-9-19(10-8-18)30-13-11-29(3)12-14-30/h5-10,15-16H,4,11-14H2,1-3H3,(H,26,27,28)