N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-[ethyl(isopropyl)amino]phenyl]-2-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-[(4-oxo-3-phenyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[4-[ethyl(propan-2-yl)amino]phenyl]-2-(4-oxo-3-phenylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[4-[ethyl(isopropyl)amino]phenyl]-2-[(4-keto-3-phenyl-quinazolin-2-yl)thio]acetamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(C)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)C(C)C

InChI

InChI=1S/C27H28N4O2S/c1-4-30(19(2)3)21-16-14-20(15-17-21)28-25(32)18-34-27-29-24-13-9-8-12-23(24)26(33)31(27)22-10-6-5-7-11-22/h5-17,19H,4,18H2,1-3H3,(H,28,32)