3-[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]-N-[2-(4-pyridin-4-ylpiperazin-1-yl)pyrimidin-5-yl]propanamide

Systemtic Name: 3-[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]-N-[2-(4-pyridin-4-ylpiperazin-1-yl)pyrimidin-5-yl]propanamide Openeye Name: 3-[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]-N-[2-[4-(4-pyridyl)piperazin-1-yl]pyrimidin-5-yl]propanamide CAS Name: 3-[(4-methoxy-2,6-dimethylphenyl)sulfonyl-methylamino]-N-[2-(4-pyridin-4-yl-1-piperazinyl)-5-pyrimidinyl]propanamide IUPAC Name: 3-[(4-methoxy-2,6-dimethylphenyl)sulfonyl-methylamino]-N-[2-(4-pyridin-4-ylpiperazin-1-yl)pyrimidin-5-yl]propanamide Traditional Name: 3-[(4-methoxy-2,6-dimethyl-phenyl)sulfonyl-methyl-amino]-N-[2-[4-(4-pyridyl)piperazino]pyrimidin-5-yl]propionamide Formula: C26H33N7O4S MolecularWeight: 539.64972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCC(=O)NC2=CN=C(N=C2)N3CCN(CC3)C4=CC=NC=C4)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)N(C)CCC(=O)NC2=CN=C(N=C2)N3CCN(CC3)C4=CC=NC=C4)C)OC

InChI

InChI=1S/C26H33N7O4S/c1-19-15-23(37-4)16-20(2)25(19)38(35,36)31(3)10-7-24(34)30-21-17-28-26(29-18-21)33-13-11-32(12-14-33)22-5-8-27-9-6-22/h5-6,8-9,15-18H,7,10-14H2,1-4H3,(H,30,34)