N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-3-pyrrolidinosulfonyl-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H26N2O4S/c1-15-9-10-20(27-3)19(13-15)16(2)22-21(24)17-7-6-8-18(14-17)28(25,26)23-11-4-5-12-23/h6-10,13-14,16H,4-5,11-12H2,1-3H3,(H,22,24)/t16-/m0/s1