N-(3-cyano-1-phenyl-4,5,6,7-tetrahydroindol-2-yl)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-cyano-1-phenyl-4,5,6,7-tetrahydroindol-2-yl)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-cyano-1-phenyl-4,5,6,7-tetrahydroindol-2-yl)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(3-cyano-1-phenyl-4,5,6,7-tetrahydroindol-2-yl)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-(3-cyano-1-phenyl-4,5,6,7-tetrahydroindol-2-yl)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(3-cyano-1-phenyl-4,5,6,7-tetrahydroindol-2-yl)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C28H25N5O2S MolecularWeight: 495.5954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(N2C3=CC=CC=C3)NC(=O)CSC4=NC5=CC=CC=C5C(=O)N4C6CC6)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(N2C3=CC=CC=C3)NC(=O)CSC4=NC5=CC=CC=C5C(=O)N4C6CC6)C#N

InChI

InChI=1S/C28H25N5O2S/c29-16-22-20-10-5-7-13-24(20)32(18-8-2-1-3-9-18)26(22)31-25(34)17-36-28-30-23-12-6-4-11-21(23)27(35)33(28)19-14-15-19/h1-4,6,8-9,11-12,19H,5,7,10,13-15,17H2,(H,31,34)