(5-chloranyl-2-propylsulfonyl-pyrimidin-4-yl)-[4-(diphenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-propylsulfonyl-pyrimidin-4-yl)-[4-(diphenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-(5-chloro-2-propylsulfonyl-pyrimidin-4-yl)methanone CAS Name: (5-chloro-2-propylsulfonyl-4-pyrimidinyl)-[4-(diphenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-(5-chloro-2-propylsulfonylpyrimidin-4-yl)methanone Traditional Name: (4-benzhydrylpiperazino)-(5-chloro-2-propylsulfonyl-pyrimidin-4-yl)methanone Formula: C25H27ClN4O3S MolecularWeight: 499.02488

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C25H27ClN4O3S/c1-2-17-34(32,33)25-27-18-21(26)22(28-25)24(31)30-15-13-29(14-16-30)23(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,18,23H,2,13-17H2,1H3