7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-3-(2-oxolanylmethyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(tetrahydrofurfuryl)-2-thioxo-1H-quinazolin-4-one Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4)NC2=S

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4)NC2=S

InChI

InChI=1S/C23H23N3O3S/c27-21(25-10-9-15-4-1-2-5-17(15)13-25)16-7-8-19-20(12-16)24-23(30)26(22(19)28)14-18-6-3-11-29-18/h1-2,4-5,7-8,12,18H,3,6,9-11,13-14H2,(H,24,30)