N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-[4-(4-bromophenyl)thiazol-2-yl]-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-[4-(4-bromophenyl)-2-thiazolyl]-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-[4-(4-bromophenyl)thiazol-2-yl]-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C21H17BrN4O2S2 MolecularWeight: 501.41928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)Br)SC3=NC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)Br)SC3=NC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C21H17BrN4O2S2/c1-12(30-21-24-16-6-4-3-5-15(16)19(28)26(21)2)18(27)25-20-23-17(11-29-20)13-7-9-14(22)10-8-13/h3-12H,1-2H3,(H,23,25,27)