N-[3-[4-(4-aminophenyl)sulfonylpiperidin-1-yl]propyl]-N-(3-chloranyl-4-methyl-phenyl)-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-[3-[4-(4-aminophenyl)sulfonylpiperidin-1-yl]propyl]-N-(3-chloranyl-4-methyl-phenyl)-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-[4-(4-aminophenyl)sulfonyl-1-piperidyl]propyl]-N-(3-chloro-4-methyl-phenyl)piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-[4-(4-aminophenyl)sulfonyl-1-piperidinyl]propyl]-N-(3-chloro-4-methylphenyl)-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-[4-(4-aminophenyl)sulfonylpiperidin-1-yl]propyl]-N-(3-chloro-4-methylphenyl)piperidine-4-carboxamide Traditional Name: 1-acetyl-N-(3-chloro-4-methyl-phenyl)-N-[3-(4-sulfanilylpiperidino)propyl]isonipecotamide Formula: C29H39ClN4O4S MolecularWeight: 575.16236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CCCN2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)N)C(=O)C4CCN(CC4)C(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N(CCCN2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)N)C(=O)C4CCN(CC4)C(=O)C)Cl

InChI

InChI=1S/C29H39ClN4O4S/c1-21-4-7-25(20-28(21)30)34(29(36)23-10-18-33(19-11-23)22(2)35)15-3-14-32-16-12-27(13-17-32)39(37,38)26-8-5-24(31)6-9-26/h4-9,20,23,27H,3,10-19,31H2,1-2H3