6-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonyl-1-propyl-pyrido[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 6-[4-(2-phenylsulfanylethyl)piperazin-1-yl]carbonyl-1-propyl-pyrido[2,3-d]pyrimidine-2,4-dione Openeye Name: 6-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]-1-propyl-pyrido[2,3-d]pyrimidine-2,4-dione CAS Name: 6-[oxo-[4-[2-(phenylthio)ethyl]-1-piperazinyl]methyl]-1-propylpyrido[2,3-d]pyrimidine-2,4-dione IUPAC Name: 6-[4-(2-phenylsulfanylethyl)piperazine-1-carbonyl]-1-propylpyrido[2,3-d]pyrimidine-2,4-dione Traditional Name: 6-[4-[2-(phenylthio)ethyl]piperazine-1-carbonyl]-1-propyl-pyrido[2,3-d]pyrimidine-2,4-quinone Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=NC=C(C=C2C(=O)NC1=O)C(=O)N3CCN(CC3)CCSC4=CC=CC=C4

Isomeric SMILES

CCCN1C2=NC=C(C=C2C(=O)NC1=O)C(=O)N3CCN(CC3)CCSC4=CC=CC=C4

InChI

InChI=1S/C23H27N5O3S/c1-2-8-28-20-19(21(29)25-23(28)31)15-17(16-24-20)22(30)27-11-9-26(10-12-27)13-14-32-18-6-4-3-5-7-18/h3-7,15-16H,2,8-14H2,1H3,(H,25,29,31)