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

Systemtic Name: (5-chloranyl-2-ethylsulfonyl-pyrimidin-4-yl)-[4-(diphenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzhydrylpiperazin-1-yl)-(5-chloro-2-ethylsulfonyl-pyrimidin-4-yl)methanone CAS Name: (5-chloro-2-ethylsulfonyl-4-pyrimidinyl)-[4-(diphenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzhydrylpiperazin-1-yl)-(5-chloro-2-ethylsulfonylpyrimidin-4-yl)methanone Traditional Name: (4-benzhydrylpiperazino)-(5-chloro-2-esyl-pyrimidin-4-yl)methanone Formula: C24H25ClN4O3S MolecularWeight: 484.9983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25ClN4O3S/c1-2-33(31,32)24-26-17-20(25)21(27-24)23(30)29-15-13-28(14-16-29)22(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,17,22H,2,13-16H2,1H3