N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide

Systemtic Name: N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-4-oxidanylidene-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Openeye Name: N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-4-oxo-3-phenyl-2-thioxo-1H-quinazoline-7-carbohydrazide CAS Name: N'-[(2S)-2-(2,3-dimethylphenoxy)-1-oxopropyl]-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide IUPAC Name: N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-4-oxo-3-phenyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Traditional Name: N'-[(2S)-2-(2,3-dimethylphenoxy)propanoyl]-4-keto-3-phenyl-2-thioxo-1H-quinazoline-7-carbohydrazide Formula: C26H24N4O4S MolecularWeight: 488.55816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC(C)C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)O[C@@H](C)C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=CC=CC=C4)C

InChI

InChI=1S/C26H24N4O4S/c1-15-8-7-11-22(16(15)2)34-17(3)23(31)28-29-24(32)18-12-13-20-21(14-18)27-26(35)30(25(20)33)19-9-5-4-6-10-19/h4-14,17H,1-3H3,(H,27,35)(H,28,31)(H,29,32)/t17-/m0/s1