N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-2-methyl-5-[(2-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-2-methyl-5-[(2-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-methyl-5-(2-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-2-methyl-5-(2-methylpiperidino)sulfonyl-benzamide Formula: C27H37N3O4S MolecularWeight: 499.66538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NCC(C3=CC(=CC=C3)OC)N4CCCC4

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC(=C(C=C2)C)C(=O)NCC(C3=CC(=CC=C3)OC)N4CCCC4

InChI

InChI=1S/C27H37N3O4S/c1-20-12-13-24(35(32,33)30-16-5-4-9-21(30)2)18-25(20)27(31)28-19-26(29-14-6-7-15-29)22-10-8-11-23(17-22)34-3/h8,10-13,17-18,21,26H,4-7,9,14-16,19H2,1-3H3,(H,28,31)