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

Systemtic Name: 5-[2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Openeye Name: 5-[2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one CAS Name: 5-[2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one IUPAC Name: 5-[2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Traditional Name: 5-[2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetyl]-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-2-one Formula: C26H30N4O3S MolecularWeight: 478.6064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C

InChI

InChI=1S/C26H30N4O3S/c1-3-4-5-10-15-29-25(33)19-11-6-7-12-20(19)28-26(29)34-17-24(32)30-18(2)16-23(31)27-21-13-8-9-14-22(21)30/h6-9,11-14,18H,3-5,10,15-17H2,1-2H3,(H,27,31)