4-[6-chloranyl-2-[2-[3-(2-methylpiperidin-1-yl)propylamino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-yl]-2-methyl-N-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[6-chloranyl-2-[2-[3-(2-methylpiperidin-1-yl)propylamino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidin-4-yl]-2-methyl-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[6-chloro-2-[2-[3-(2-methyl-1-piperidyl)propylamino]-2-oxo-ethyl]sulfanyl-pyrimidin-4-yl]-N-isopropyl-2-methyl-piperazine-1-carboxamide CAS Name: 4-[6-chloro-2-[[2-[3-(2-methyl-1-piperidinyl)propylamino]-2-oxoethyl]thio]-4-pyrimidinyl]-2-methyl-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[6-chloro-2-[2-[3-(2-methylpiperidin-1-yl)propylamino]-2-oxoethyl]sulfanylpyrimidin-4-yl]-2-methyl-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[6-chloro-2-[[2-keto-2-[3-(2-methylpiperidino)propylamino]ethyl]thio]pyrimidin-4-yl]-N-isopropyl-2-methyl-piperazine-1-carboxamide Formula: C24H40ClN7O2S MolecularWeight: 526.1381

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC(=O)CSC2=NC(=CC(=N2)Cl)N3CCN(C(C3)C)C(=O)NC(C)C

Isomeric SMILES

CC1CCCCN1CCCNC(=O)CSC2=NC(=CC(=N2)Cl)N3CCN(C(C3)C)C(=O)NC(C)C

InChI

InChI=1S/C24H40ClN7O2S/c1-17(2)27-24(34)32-13-12-31(15-19(32)4)21-14-20(25)28-23(29-21)35-16-22(33)26-9-7-11-30-10-6-5-8-18(30)3/h14,17-19H,5-13,15-16H2,1-4H3,(H,26,33)(H,27,34)