N-[2-(dimethylamino)-3-methyl-butyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[2-(dimethylamino)-3-methylbutyl]-4-(2,5-dimethylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[2-(dimethylamino)-3-methylbutyl]-4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[2-(dimethylamino)-3-methyl-butyl]-4-(2,5-dimethylphenyl)sulfonyl-piperazine-1-carboxamide Formula: C20H34N4O3S MolecularWeight: 410.57396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)NCC(C(C)C)N(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)NCC(C(C)C)N(C)C

InChI

InChI=1S/C20H34N4O3S/c1-15(2)18(22(5)6)14-21-20(25)23-9-11-24(12-10-23)28(26,27)19-13-16(3)7-8-17(19)4/h7-8,13,15,18H,9-12,14H2,1-6H3,(H,21,25)