N-cyclopropyl-2-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclopropyl-2-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanyl-ethanamide Openeye Name: N-cyclopropyl-2-[6-ethyl-2-(m-tolyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-cyclopropyl-2-[[6-ethyl-2-(3-methylphenyl)-4-quinazolinyl]thio]acetamide IUPAC Name: N-cyclopropyl-2-[6-ethyl-2-(3-methylphenyl)quinazolin-4-yl]sulfanylacetamide Traditional Name: N-cyclopropyl-2-[[6-ethyl-2-(m-tolyl)quinazolin-4-yl]thio]acetamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3CC3)C4=CC(=CC=C4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(N=C2SCC(=O)NC3CC3)C4=CC(=CC=C4)C

InChI

InChI=1S/C22H23N3OS/c1-3-15-7-10-19-18(12-15)22(27-13-20(26)23-17-8-9-17)25-21(24-19)16-6-4-5-14(2)11-16/h4-7,10-12,17H,3,8-9,13H2,1-2H3,(H,23,26)