2-[(4-methoxyphenyl)-methylsulfonyl-amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide

Systemtic Name: 2-[(4-methoxyphenyl)-methylsulfonyl-amino]-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide Openeye Name: 2-(4-methoxy-N-methylsulfonyl-anilino)-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide CAS Name: 2-(4-methoxy-N-methylsulfonylanilino)-N-[[4-(1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: 2-(4-methoxy-N-methylsulfonylanilino)-N-[(4-pyrrolidin-1-ylphenyl)methyl]propanamide Traditional Name: 2-(N-mesyl-4-methoxy-anilino)-N-(4-pyrrolidinobenzyl)propionamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)N2CCCC2)N(C3=CC=C(C=C3)OC)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)N2CCCC2)N(C3=CC=C(C=C3)OC)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O4S/c1-17(25(30(3,27)28)20-10-12-21(29-2)13-11-20)22(26)23-16-18-6-8-19(9-7-18)24-14-4-5-15-24/h6-13,17H,4-5,14-16H2,1-3H3,(H,23,26)