2-[2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Openeye Name: 2-[2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanylpropanoylamino]thiophene-3-carboxamide CAS Name: 2-[[2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-1-oxopropyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanoylamino]thiophene-3-carboxamide Traditional Name: 2-[2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]propanoylamino]thiophene-3-carboxamide Formula: C18H17BrN4O3S2 MolecularWeight: 481.38658

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3=C(C=CS3)C(=O)N

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SC(C)C(=O)NC3=C(C=CS3)C(=O)N

InChI

InChI=1S/C18H17BrN4O3S2/c1-3-23-17(26)12-8-10(19)4-5-13(12)21-18(23)28-9(2)15(25)22-16-11(14(20)24)6-7-27-16/h4-9H,3H2,1-2H3,(H2,20,24)(H,22,25)