(2S)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)propanamide

Systemtic Name: (2S)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)propanamide Openeye Name: (2S)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-isopropylphenyl)propanamide CAS Name: (2S)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: (2S)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-propan-2-ylphenyl)propanamide Traditional Name: (2S)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-p-cumenyl-propionamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(C)C)SC2=NC3=CC=CC=C3C(=O)N2C4CC4

InChI

InChI=1S/C23H25N3O2S/c1-14(2)16-8-10-17(11-9-16)24-21(27)15(3)29-23-25-20-7-5-4-6-19(20)22(28)26(23)18-12-13-18/h4-11,14-15,18H,12-13H2,1-3H3,(H,24,27)/t15-/m0/s1