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

Systemtic Name: 2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-cyclopropylethyl)-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[3-(4-cyanophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(1-cyclopropylethyl)acetamide CAS Name: 2-[[3-(4-cyanophenyl)-4-oxo-2-quinazolinyl]thio]-N-(1-cyclopropylethyl)-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-(4-cyanophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1-cyclopropylethyl)acetamide Traditional Name: N-benzyl-2-[[3-(4-cyanophenyl)-4-keto-quinazolin-2-yl]thio]-N-(1-cyclopropylethyl)acetamide Formula: C29H26N4O2S MolecularWeight: 494.60734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)N(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

Isomeric SMILES

CC(C1CC1)N(CC2=CC=CC=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H26N4O2S/c1-20(23-13-14-23)32(18-22-7-3-2-4-8-22)27(34)19-36-29-31-26-10-6-5-9-25(26)28(35)33(29)24-15-11-21(17-30)12-16-24/h2-12,15-16,20,23H,13-14,18-19H2,1H3