N-(4-methylpentyl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(4-methylpentyl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-isohexyl-4-(p-tolylsulfonyl)piperazine-1-carboxamide CAS Name: N-(4-methylpentyl)-4-(4-methylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(4-methylpentyl)-4-(4-methylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-isohexyl-4-tosyl-piperazine-1-carboxamide Formula: C18H29N3O3S MolecularWeight: 367.50616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCCCC(C)C

InChI

InChI=1S/C18H29N3O3S/c1-15(2)5-4-10-19-18(22)20-11-13-21(14-12-20)25(23,24)17-8-6-16(3)7-9-17/h6-9,15H,4-5,10-14H2,1-3H3,(H,19,22)