2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(diphenylmethyl)propanamide

Systemtic Name: 2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(diphenylmethyl)propanamide Openeye Name: N-benzhydryl-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: 2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-(diphenylmethyl)propanamide IUPAC Name: N-benzhydryl-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-benzhydryl-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C27H25N3O2S MolecularWeight: 455.5713

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C5CC5

Isomeric SMILES

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC4=CC=CC=C4C(=O)N3C5CC5

InChI

InChI=1S/C27H25N3O2S/c1-18(25(31)29-24(19-10-4-2-5-11-19)20-12-6-3-7-13-20)33-27-28-23-15-9-8-14-22(23)26(32)30(27)21-16-17-21/h2-15,18,21,24H,16-17H2,1H3,(H,29,31)