N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-oxidanylidene-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-oxidanylidene-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[3-(4-isopropylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[[4-oxo-3-(4-propan-2-ylphenyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-2-[4-oxo-3-(4-propan-2-ylphenyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[(4-keto-3-p-cumenyl-quinazolin-2-yl)thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C27H24N4O3S2 MolecularWeight: 516.63446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NC5=C(S4)C=C(C=C5)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=NC5=C(S4)C=C(C=C5)OC

InChI

InChI=1S/C27H24N4O3S2/c1-16(2)17-8-10-18(11-9-17)31-25(33)20-6-4-5-7-21(20)29-27(31)35-15-24(32)30-26-28-22-13-12-19(34-3)14-23(22)36-26/h4-14,16H,15H2,1-3H3,(H,28,30,32)