(2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide

Systemtic Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide Openeye Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide CAS Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-[3-(1-pyrrolidinylmethyl)phenyl]propanamide IUPAC Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-[3-(pyrrolidin-1-ylmethyl)phenyl]propanamide Traditional Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-N-[3-(pyrrolidinomethyl)phenyl]propionamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)CN2CCCC2)NS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC(=C1)CN2CCCC2)NS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27N3O4S/c1-16(23-29(26,27)20-10-8-19(28-2)9-11-20)21(25)22-18-7-5-6-17(14-18)15-24-12-3-4-13-24/h5-11,14,16,23H,3-4,12-13,15H2,1-2H3,(H,22,25)/t16-/m0/s1