4-[2-[(4-tert-butylphenyl)sulfonylamino]-3-methyl-pentanoyl]-N-(3-chlorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[2-[(4-tert-butylphenyl)sulfonylamino]-3-methyl-pentanoyl]-N-(3-chlorophenyl)piperazine-1-carboxamide Openeye Name: 4-[2-[(4-tert-butylphenyl)sulfonylamino]-3-methyl-pentanoyl]-N-(3-chlorophenyl)piperazine-1-carboxamide CAS Name: 4-[2-[(4-tert-butylphenyl)sulfonylamino]-3-methyl-1-oxopentyl]-N-(3-chlorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[2-[(4-tert-butylphenyl)sulfonylamino]-3-methylpentanoyl]-N-(3-chlorophenyl)piperazine-1-carboxamide Traditional Name: 4-[2-[(4-tert-butylphenyl)sulfonylamino]-3-methyl-pentanoyl]-N-(3-chlorophenyl)piperazine-1-carboxamide Formula: C27H37ClN4O4S MolecularWeight: 549.12508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C(=O)NC2=CC(=CC=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C(=O)NC2=CC(=CC=C2)Cl)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C27H37ClN4O4S/c1-6-19(2)24(30-37(35,36)23-12-10-20(11-13-23)27(3,4)5)25(33)31-14-16-32(17-15-31)26(34)29-22-9-7-8-21(28)18-22/h7-13,18-19,24,30H,6,14-17H2,1-5H3,(H,29,34)