N-[3-[4-[(4-ethylsulfonylphenyl)methyl]piperidin-1-yl]propyl]-1-methylsulfonyl-N-phenyl-piperidine-4-carboxamide hydrochloride

Systemtic Name: N-[3-[4-[(4-ethylsulfonylphenyl)methyl]piperidin-1-yl]propyl]-1-methylsulfonyl-N-phenyl-piperidine-4-carboxamide hydrochloride Openeye Name: N-[3-[4-[(4-ethylsulfonylphenyl)methyl]-1-piperidyl]propyl]-1-methylsulfonyl-N-phenyl-piperidine-4-carboxamide hydrochloride CAS Name: N-[3-[4-[(4-ethylsulfonylphenyl)methyl]-1-piperidinyl]propyl]-1-methylsulfonyl-N-phenyl-4-piperidinecarboxamide hydrochloride IUPAC Name: N-[3-[4-[(4-ethylsulfonylphenyl)methyl]piperidin-1-yl]propyl]-1-methylsulfonyl-N-phenylpiperidine-4-carboxamide hydrochloride Traditional Name: N-[3-[4-(4-esylbenzyl)piperidino]propyl]-1-mesyl-N-phenyl-isonipecotamide hydrochloride Formula: C30H44ClN3O5S2 MolecularWeight: 626.27046

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)CC2CCN(CC2)CCCN(C3=CC=CC=C3)C(=O)C4CCN(CC4)S(=O)(=O)C.Cl

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)CC2CCN(CC2)CCCN(C3=CC=CC=C3)C(=O)C4CCN(CC4)S(=O)(=O)C.Cl

InChI

InChI=1S/C30H43N3O5S2.ClH/c1-3-40(37,38)29-12-10-25(11-13-29)24-26-14-20-31(21-15-26)18-7-19-33(28-8-5-4-6-9-28)30(34)27-16-22-32(23-17-27)39(2,35)36;/h4-6,8-13,26-27H,3,7,14-24H2,1-2H3;1H