(2S)-N-[2-[(2S)-butan-2-yl]pyrazol-3-yl]-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-[2-[(2S)-butan-2-yl]pyrazol-3-yl]-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-[(1S)-1-methylpropyl]pyrazol-3-yl]propanamide CAS Name: (2S)-N-[2-[(2S)-butan-2-yl]-3-pyrazolyl]-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]propanamide IUPAC Name: (2S)-N-[2-[(2S)-butan-2-yl]pyrazol-3-yl]-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2S)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-[2-[(1S)-1-methylpropyl]pyrazol-3-yl]propionamide Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=CC=N1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C(C)C

Isomeric SMILES

CC[C@H](C)N1C(=CC=N1)NC(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2C(C)C

InChI

InChI=1S/C21H27N5O2S/c1-6-14(4)26-18(11-12-22-26)24-19(27)15(5)29-21-23-17-10-8-7-9-16(17)20(28)25(21)13(2)3/h7-15H,6H2,1-5H3,(H,24,27)/t14-,15-/m0/s1