2-[(5,7-dimethyl-4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(5,7-dimethyl-4-oxidanylidene-1H-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(5,7-dimethyl-4-oxo-1H-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(5,7-dimethyl-4-oxo-1H-pyrido[2,3-d]pyrimidin-2-yl)thio]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(5,7-dimethyl-4-oxo-1H-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(4-keto-5,7-dimethyl-1H-pyrido[2,3-d]pyrimidin-2-yl)thio]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C21H23N5O4S2 MolecularWeight: 473.56842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=O)N=C(N2)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=O)N=C(N2)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C21H23N5O4S2/c1-13-10-14(2)22-19-18(13)20(28)25-21(24-19)31-12-17(27)23-15-6-5-7-16(11-15)32(29,30)26-8-3-4-9-26/h5-7,10-11H,3-4,8-9,12H2,1-2H3,(H,23,27)(H,22,24,25,28)