N-(2-azanylethyl)-N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]pyridine-2-sulfonamide

Systemtic Name: N-(2-azanylethyl)-N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]pyridine-2-sulfonamide Openeye Name: N-(2-aminoethyl)-N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]pyridine-2-sulfonamide CAS Name: N-(2-aminoethyl)-N-[6-cyano-1-[(3-methyl-4-imidazolyl)methyl]-3,4-dihydro-2H-quinolin-3-yl]-2-pyridinesulfonamide IUPAC Name: N-(2-aminoethyl)-N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]pyridine-2-sulfonamide Traditional Name: N-(2-aminoethyl)-N-[6-cyano-1-[(3-methylimidazol-4-yl)methyl]-3,4-dihydro-2H-quinolin-3-yl]pyridine-2-sulfonamide Formula: C22H25N7O2S MolecularWeight: 451.5446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1CN2CC(CC3=C2C=CC(=C3)C#N)N(CCN)S(=O)(=O)C4=CC=CC=N4

Isomeric SMILES

CN1C=NC=C1CN2CC(CC3=C2C=CC(=C3)C#N)N(CCN)S(=O)(=O)C4=CC=CC=N4

InChI

InChI=1S/C22H25N7O2S/c1-27-16-25-13-20(27)15-28-14-19(11-18-10-17(12-24)5-6-21(18)28)29(9-7-23)32(30,31)22-4-2-3-8-26-22/h2-6,8,10,13,16,19H,7,9,11,14-15,23H2,1H3