2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(2S)-6-methylheptan-2-yl]ethanamide

Systemtic Name: 2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(2S)-6-methylheptan-2-yl]ethanamide Openeye Name: 2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1S)-1,5-dimethylhexyl]acetamide CAS Name: 2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-[(2S)-6-methylheptan-2-yl]acetamide IUPAC Name: 2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(2S)-6-methylheptan-2-yl]acetamide Traditional Name: 2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-[(1S)-1,5-dimethylhexyl]acetamide Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CC3

Isomeric SMILES

C[C@@H](CCCC(C)C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CC3

InChI

InChI=1S/C21H29N3O2S/c1-14(2)7-6-8-15(3)22-19(25)13-27-21-23-18-10-5-4-9-17(18)20(26)24(21)16-11-12-16/h4-5,9-10,14-16H,6-8,11-13H2,1-3H3,(H,22,25)/t15-/m0/s1