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

Systemtic Name: N-[(3R)-1-cyanopyrrolidin-3-yl]-5-(furan-2-ylamino)-2-methyl-benzenesulfonamide Openeye Name: N-[(3R)-1-cyanopyrrolidin-3-yl]-5-(2-furylamino)-2-methyl-benzenesulfonamide CAS Name: N-[(3R)-1-cyano-3-pyrrolidinyl]-5-(2-furanylamino)-2-methylbenzenesulfonamide IUPAC Name: N-[(3R)-1-cyanopyrrolidin-3-yl]-5-(furan-2-ylamino)-2-methylbenzenesulfonamide Traditional Name: N-[(3R)-1-cyanopyrrolidin-3-yl]-5-(2-furylamino)-2-methyl-benzenesulfonamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=CC=CO2)S(=O)(=O)NC3CCN(C3)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=CC=CO2)S(=O)(=O)N[C@@H]3CCN(C3)C#N

InChI

InChI=1S/C16H18N4O3S/c1-12-4-5-13(18-16-3-2-8-23-16)9-15(12)24(21,22)19-14-6-7-20(10-14)11-17/h2-5,8-9,14,18-19H,6-7,10H2,1H3/t14-/m1/s1