N-[(1R)-1-cyclopropylethyl]-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(1R)-1-cyclopropylethyl]-2-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(1R)-1-cyclopropylethyl]-2-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(1R)-1-cyclopropylethyl]-2-[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(C)C4CC4

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N[C@H](C)C4CC4

InChI

InChI=1S/C23H25N3O2S/c1-3-16-8-12-18(13-9-16)26-22(28)19-6-4-5-7-20(19)25-23(26)29-14-21(27)24-15(2)17-10-11-17/h4-9,12-13,15,17H,3,10-11,14H2,1-2H3,(H,24,27)/t15-/m1/s1