1-(3-methoxyphenyl)-2-methyl-N-(3-methylbutyl)-4-(4-methylphenyl)sulfonyl-6-oxidanylidene-piperazine-2-carboxamide

Systemtic Name: 1-(3-methoxyphenyl)-2-methyl-N-(3-methylbutyl)-4-(4-methylphenyl)sulfonyl-6-oxidanylidene-piperazine-2-carboxamide Openeye Name: N-isopentyl-1-(3-methoxyphenyl)-2-methyl-6-oxo-4-(p-tolylsulfonyl)piperazine-2-carboxamide CAS Name: 1-(3-methoxyphenyl)-2-methyl-N-(3-methylbutyl)-4-(4-methylphenyl)sulfonyl-6-oxo-2-piperazinecarboxamide IUPAC Name: 1-(3-methoxyphenyl)-2-methyl-N-(3-methylbutyl)-4-(4-methylphenyl)sulfonyl-6-oxopiperazine-2-carboxamide Traditional Name: N-isoamyl-6-keto-1-(3-methoxyphenyl)-2-methyl-4-tosyl-piperazine-2-carboxamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)N(C(C2)(C)C(=O)NCCC(C)C)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)N(C(C2)(C)C(=O)NCCC(C)C)C3=CC(=CC=C3)OC

InChI

InChI=1S/C25H33N3O5S/c1-18(2)13-14-26-24(30)25(4)17-27(34(31,32)22-11-9-19(3)10-12-22)16-23(29)28(25)20-7-6-8-21(15-20)33-5/h6-12,15,18H,13-14,16-17H2,1-5H3,(H,26,30)