N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-[ethyl-(3-methylphenyl)amino]ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[2-(N-ethyl-3-methylanilino)ethyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(N-ethyl-3-methyl-anilino)ethyl]-4-pyrrolidinosulfonyl-benzamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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