N-[3-[2-azanyl-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxidanylidene-propyl]-1H-indol-5-yl]methanesulfonamide

Systemtic Name: N-[3-[2-azanyl-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxidanylidene-propyl]-1H-indol-5-yl]methanesulfonamide Openeye Name: N-[3-[2-amino-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxo-propyl]-1H-indol-5-yl]methanesulfonamide CAS Name: N-[3-[2-amino-3-[(2S)-2-cyano-1-pyrrolidinyl]-3-oxopropyl]-1H-indol-5-yl]methanesulfonamide IUPAC Name: N-[3-[2-amino-3-[(2S)-2-cyanopyrrolidin-1-yl]-3-oxopropyl]-1H-indol-5-yl]methanesulfonamide Traditional Name: N-[3-[2-amino-3-[(2S)-2-cyanopyrrolidino]-3-keto-propyl]-1H-indol-5-yl]methanesulfonamide Formula: C17H21N5O3S MolecularWeight: 375.44534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC2=C(C=C1)NC=C2CC(C(=O)N3CCCC3C#N)N

Isomeric SMILES

CS(=O)(=O)NC1=CC2=C(C=C1)NC=C2CC(C(=O)N3CCC[C@H]3C#N)N

InChI

InChI=1S/C17H21N5O3S/c1-26(24,25)21-12-4-5-16-14(8-12)11(10-20-16)7-15(19)17(23)22-6-2-3-13(22)9-18/h4-5,8,10,13,15,20-21H,2-3,6-7,19H2,1H3/t13-,15?/m0/s1