N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-3-pyrrolidinosulfonyl-benzamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CCNC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C3=CC=CC(=C3)C

InChI

InChI=1S/C22H29N3O3S/c1-3-24(20-10-6-8-18(2)16-20)15-12-23-22(26)19-9-7-11-21(17-19)29(27,28)25-13-4-5-14-25/h6-11,16-17H,3-5,12-15H2,1-2H3,(H,23,26)