3-cyclopentyl-1-[4-[2-[[4-(3,4-dichlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-2-methyl-piperazin-1-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[4-[2-[[4-(3,4-dichlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-2-methyl-piperazin-1-yl]propan-1-one Openeye Name: 3-cyclopentyl-1-[4-[2-[[4-(3,4-dichlorophenyl)-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2-methyl-piperazin-1-yl]propan-1-one CAS Name: 3-cyclopentyl-1-[4-[2-[[4-(3,4-dichlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-2-methyl-1-piperazinyl]-1-propanone IUPAC Name: 3-cyclopentyl-1-[4-[2-[[4-(3,4-dichlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-2-methylpiperazin-1-yl]propan-1-one Traditional Name: 3-cyclopentyl-1-[4-[2-[[4-(3,4-dichlorophenyl)-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetyl]-2-methyl-piperazino]propan-1-one Formula: C30H35Cl2N5O2S MolecularWeight: 600.6022

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CCC2CCCC2)C(=O)CSC3=NN=C(N3C4=CC(=C(C=C4)Cl)Cl)C5=CC=C(C=C5)C

Isomeric SMILES

CC1CN(CCN1C(=O)CCC2CCCC2)C(=O)CSC3=NN=C(N3C4=CC(=C(C=C4)Cl)Cl)C5=CC=C(C=C5)C

InChI

InChI=1S/C30H35Cl2N5O2S/c1-20-7-10-23(11-8-20)29-33-34-30(37(29)24-12-13-25(31)26(32)17-24)40-19-28(39)35-15-16-36(21(2)18-35)27(38)14-9-22-5-3-4-6-22/h7-8,10-13,17,21-22H,3-6,9,14-16,18-19H2,1-2H3