N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-3-(3-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-3-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-3-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-3-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-3-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]-3-(3-methylpiperidino)sulfonyl-benzamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC(C3=CC=C(C=C3)OC)N4CCCCC4

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCC(C3=CC=C(C=C3)OC)N4CCCCC4

InChI

InChI=1S/C27H37N3O4S/c1-21-8-7-17-30(20-21)35(32,33)25-10-6-9-23(18-25)27(31)28-19-26(29-15-4-3-5-16-29)22-11-13-24(34-2)14-12-22/h6,9-14,18,21,26H,3-5,7-8,15-17,19-20H2,1-2H3,(H,28,31)