6-ethyl-1,3-dimethyl-5-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-pyrido[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 6-ethyl-1,3-dimethyl-5-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-pyrido[2,3-d]pyrimidine-2,4-dione Openeye Name: 6-ethyl-1,3-dimethyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-pyrido[2,3-d]pyrimidine-2,4-dione CAS Name: 6-ethyl-1,3-dimethyl-5-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]pyrido[2,3-d]pyrimidine-2,4-dione IUPAC Name: 6-ethyl-1,3-dimethyl-5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanylpyrido[2,3-d]pyrimidine-2,4-dione Traditional Name: 6-ethyl-5-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]-1,3-dimethyl-pyrido[2,3-d]pyrimidine-2,4-quinone Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C2C(=C1SCC(=O)N3CCN(CC3)C4=CC=CC=C4)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCC1=CN=C2C(=C1SCC(=O)N3CCN(CC3)C4=CC=CC=C4)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C23H27N5O3S/c1-4-16-14-24-21-19(22(30)26(3)23(31)25(21)2)20(16)32-15-18(29)28-12-10-27(11-13-28)17-8-6-5-7-9-17/h5-9,14H,4,10-13,15H2,1-3H3