N-[(4-chlorophenyl)-cyclopropyl-methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-[(4-chlorophenyl)-cyclopropylmethyl]-4-(4-methoxyphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-[(4-chlorophenyl)-cyclopropylmethyl]-4-(4-methoxyphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-[(4-chlorophenyl)-cyclopropyl-methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine-1-carboxamide Formula: C22H26ClN3O4S MolecularWeight: 463.97754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC(C3CC3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC(C3CC3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H26ClN3O4S/c1-30-19-8-10-20(11-9-19)31(28,29)26-14-12-25(13-15-26)22(27)24-21(16-2-3-16)17-4-6-18(23)7-5-17/h4-11,16,21H,2-3,12-15H2,1H3,(H,24,27)