4-(5-chloranyl-2-methyl-phenyl)-N'-(4-propan-2-ylphenyl)sulfonyl-piperazine-1-carboximidamide

Systemtic Name: 4-(5-chloranyl-2-methyl-phenyl)-N'-(4-propan-2-ylphenyl)sulfonyl-piperazine-1-carboximidamide Openeye Name: 4-(5-chloro-2-methyl-phenyl)-N'-(4-isopropylphenyl)sulfonyl-piperazine-1-carboxamidine CAS Name: 4-(5-chloro-2-methylphenyl)-N'-(4-propan-2-ylphenyl)sulfonyl-1-piperazinecarboximidamide IUPAC Name: 4-(5-chloro-2-methylphenyl)-N'-(4-propan-2-ylphenyl)sulfonylpiperazine-1-carboximidamide Traditional Name: 4-(5-chloro-2-methyl-phenyl)-N'-p-cumenylsulfonyl-piperazine-1-carboxamidine Formula: C21H27ClN4O2S MolecularWeight: 434.98268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=NS(=O)(=O)C3=CC=C(C=C3)C(C)C)N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)/C(=N/S(=O)(=O)C3=CC=C(C=C3)C(C)C)/N

InChI

InChI=1S/C21H27ClN4O2S/c1-15(2)17-5-8-19(9-6-17)29(27,28)24-21(23)26-12-10-25(11-13-26)20-14-18(22)7-4-16(20)3/h4-9,14-15H,10-13H2,1-3H3,(H2,23,24)