(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone

Systemtic Name: (4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone Openeye Name: (4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-thioxo-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone CAS Name: (4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone IUPAC Name: (4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-sulfanylidene-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone Traditional Name: (4-phenyl-3,6-dihydro-2H-pyridin-1-yl)-[4-[[(2-thioxo-1H-quinazolin-4-yl)amino]methyl]cyclohexyl]methanone Formula: C27H30N4OS MolecularWeight: 458.6183

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC2=NC(=S)NC3=CC=CC=C32)C(=O)N4CCC(=CC4)C5=CC=CC=C5

Isomeric SMILES

C1CC(CCC1CNC2=NC(=S)NC3=CC=CC=C32)C(=O)N4CCC(=CC4)C5=CC=CC=C5

InChI

InChI=1S/C27H30N4OS/c32-26(31-16-14-21(15-17-31)20-6-2-1-3-7-20)22-12-10-19(11-13-22)18-28-25-23-8-4-5-9-24(23)29-27(33)30-25/h1-9,14,19,22H,10-13,15-18H2,(H2,28,29,30,33)