N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-[(4S)-chroman-4-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: N-[(4S)-3,4-dihydro-2H-1-benzopyran-4-yl]-3-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-[(4S)-chroman-4-yl]-3-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3CCOC4=CC=CC=C34

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)N[C@H]3CCOC4=CC=CC=C34

InChI

InChI=1S/C22H26N2O4S/c25-22(23-20-13-16-28-21-6-2-1-5-19(20)21)12-9-17-7-10-18(11-8-17)29(26,27)24-14-3-4-15-24/h1-2,5-8,10-11,20H,3-4,9,12-16H2,(H,23,25)/t20-/m0/s1