2-[(4-methylphenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)propanamide

Systemtic Name: 2-[(4-methylphenyl)-methylsulfonyl-amino]-N-(3-pyrrolidin-1-ylpropyl)propanamide Openeye Name: 2-(4-methyl-N-methylsulfonyl-anilino)-N-(3-pyrrolidin-1-ylpropyl)propanamide CAS Name: 2-(4-methyl-N-methylsulfonylanilino)-N-[3-(1-pyrrolidinyl)propyl]propanamide IUPAC Name: 2-(4-methyl-N-methylsulfonylanilino)-N-(3-pyrrolidin-1-ylpropyl)propanamide Traditional Name: 2-(N-mesyl-4-methyl-anilino)-N-(3-pyrrolidinopropyl)propionamide Formula: C18H29N3O3S MolecularWeight: 367.50616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(C)C(=O)NCCCN2CCCC2)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C(C)C(=O)NCCCN2CCCC2)S(=O)(=O)C

InChI

InChI=1S/C18H29N3O3S/c1-15-7-9-17(10-8-15)21(25(3,23)24)16(2)18(22)19-11-6-14-20-12-4-5-13-20/h7-10,16H,4-6,11-14H2,1-3H3,(H,19,22)