N-[4-[(2R)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]phenyl]ethanamide

Systemtic Name: N-[4-[(2R)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoyl]phenyl]ethanamide Openeye Name: N-[4-[(2R)-2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylpropanoyl]phenyl]acetamide CAS Name: N-[4-[(2R)-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]phenyl]acetamide IUPAC Name: N-[4-[(2R)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanoyl]phenyl]acetamide Traditional Name: N-[4-[(2R)-2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]propanoyl]phenyl]acetamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

C[C@H](C(=O)C1=CC=C(C=C1)NC(=O)C)SC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C23H25N3O3S/c1-14(2)13-26-22(29)19-7-5-6-8-20(19)25-23(26)30-15(3)21(28)17-9-11-18(12-10-17)24-16(4)27/h5-12,14-15H,13H2,1-4H3,(H,24,27)/t15-/m1/s1