4-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)carbonyl]benzenecarbonitrile

Systemtic Name: 4-[(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)carbonyl]benzenecarbonitrile Openeye Name: 4-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinoline-1-carbonyl)benzonitrile CAS Name: 4-[oxo-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]methyl]benzonitrile IUPAC Name: 4-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinoline-1-carbonyl)benzonitrile Traditional Name: 4-(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinoline-1-carbonyl)benzonitrile Formula: C21H21N3O3S MolecularWeight: 395.47474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H21N3O3S/c22-15-16-5-7-17(8-6-16)21(25)24-13-3-4-18-14-19(9-10-20(18)24)28(26,27)23-11-1-2-12-23/h5-10,14H,1-4,11-13H2