1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-2-quinazolin-4-ylsulfanyl-ethanone

Systemtic Name: 1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-2-quinazolin-4-ylsulfanyl-ethanone Openeye Name: 1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-2-quinazolin-4-ylsulfanyl-ethanone CAS Name: 1-[6-(1-pyrrolidinylsulfonyl)-3,4-dihydro-2H-quinolin-1-yl]-2-(4-quinazolinylthio)ethanone IUPAC Name: 1-(6-pyrrolidin-1-ylsulfonyl-3,4-dihydro-2H-quinolin-1-yl)-2-quinazolin-4-ylsulfanylethanone Traditional Name: 1-(6-pyrrolidinosulfonyl-3,4-dihydro-2H-quinolin-1-yl)-2-(quinazolin-4-ylthio)ethanone Formula: C23H24N4O3S2 MolecularWeight: 468.59166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)CSC4=NC=NC5=CC=CC=C54

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)N(CCC3)C(=O)CSC4=NC=NC5=CC=CC=C54

InChI

InChI=1S/C23H24N4O3S2/c28-22(15-31-23-19-7-1-2-8-20(19)24-16-25-23)27-13-5-6-17-14-18(9-10-21(17)27)32(29,30)26-11-3-4-12-26/h1-2,7-10,14,16H,3-6,11-13,15H2