2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone

Systemtic Name: 2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Openeye Name: 2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone CAS Name: 2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-1-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]ethanone IUPAC Name: 2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Traditional Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-1-(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinolin-1-yl)ethanone Formula: C20H25N5O3S2 MolecularWeight: 447.5742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)N2CCCC3=C2C=CC(=C3)S(=O)(=O)N4CCCC4)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)N2CCCC3=C2C=CC(=C3)S(=O)(=O)N4CCCC4)N

InChI

InChI=1S/C20H25N5O3S2/c1-14-11-18(21)23-20(22-14)29-13-19(26)25-10-4-5-15-12-16(6-7-17(15)25)30(27,28)24-8-2-3-9-24/h6-7,11-12H,2-5,8-10,13H2,1H3,(H2,21,22,23)