5-cyclopentyl-2-(2-methylprop-2-enylsulfanyl)-5,6-dihydro-1H-benzo[h]quinazolin-4-one

Systemtic Name: 5-cyclopentyl-2-(2-methylprop-2-enylsulfanyl)-5,6-dihydro-1H-benzo[h]quinazolin-4-one Openeye Name: 5-cyclopentyl-2-(2-methylallylsulfanyl)-5,6-dihydro-1H-benzo[h]quinazolin-4-one CAS Name: 5-cyclopentyl-2-(2-methylprop-2-enylthio)-5,6-dihydro-1H-benzo[h]quinazolin-4-one IUPAC Name: 5-cyclopentyl-2-(2-methylprop-2-enylsulfanyl)-5,6-dihydro-1H-benzo[h]quinazolin-4-one Traditional Name: 5-cyclopentyl-2-(2-methylallylthio)-5,6-dihydro-1H-benzo[h]quinazolin-4-one Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NC(=O)C2=C(N1)C3=CC=CC=C3CC2C4CCCC4

Isomeric SMILES

CC(=C)CSC1=NC(=O)C2=C(N1)C3=CC=CC=C3CC2C4CCCC4

InChI

InChI=1S/C21H24N2OS/c1-13(2)12-25-21-22-19-16-10-6-5-9-15(16)11-17(14-7-3-4-8-14)18(19)20(24)23-21/h5-6,9-10,14,17H,1,3-4,7-8,11-12H2,2H3,(H,22,23,24)