5-[2-[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one

Systemtic Name: 5-[2-[3-(2-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-[3-(2-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[2-[[3-(2-ethylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-[3-(2-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-[[3-(2-ethylphenyl)-4-keto-quinazolin-2-yl]thio]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C28H26N4O3S MolecularWeight: 498.59604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4C(CC(=O)NC5=CC=CC=C54)C

Isomeric SMILES

CCC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4C(CC(=O)NC5=CC=CC=C54)C

InChI

InChI=1S/C28H26N4O3S/c1-3-19-10-4-8-14-23(19)32-27(35)20-11-5-6-12-21(20)30-28(32)36-17-26(34)31-18(2)16-25(33)29-22-13-7-9-15-24(22)31/h4-15,18H,3,16-17H2,1-2H3,(H,29,33)