N-(4-ethylphenyl)-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-ethylphenyl)-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-ethylphenyl)-2-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(4-ethylphenyl)-2-[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(4-ethylphenyl)-2-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(4-ethylphenyl)-2-[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)CC

InChI

InChI=1S/C27H27N3O2S/c1-4-19-10-14-21(15-11-19)28-25(31)18(3)33-27-29-24-9-7-6-8-23(24)26(32)30(27)22-16-12-20(5-2)13-17-22/h6-18H,4-5H2,1-3H3,(H,28,31)