N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methyl-5-(pentylamino)benzenesulfonamide

Systemtic Name: N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methyl-5-(pentylamino)benzenesulfonamide Openeye Name: N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methyl-5-(pentylamino)benzenesulfonamide CAS Name: N-[(3R)-1-cyano-3-pyrrolidinyl]-2-methyl-5-(pentylamino)benzenesulfonamide IUPAC Name: N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methyl-5-(pentylamino)benzenesulfonamide Traditional Name: 5-(amylamino)-N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methyl-benzenesulfonamide Formula: C17H26N4O2S MolecularWeight: 350.47894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=CC(=C(C=C1)C)S(=O)(=O)NC2CCN(C2)C#N

Isomeric SMILES

CCCCCNC1=CC(=C(C=C1)C)S(=O)(=O)N[C@@H]2CCN(C2)C#N

InChI

InChI=1S/C17H26N4O2S/c1-3-4-5-9-19-15-7-6-14(2)17(11-15)24(22,23)20-16-8-10-21(12-16)13-18/h6-7,11,16,19-20H,3-5,8-10,12H2,1-2H3/t16-/m1/s1