N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-(4-keto-2-thioxo-1H-quinazolin-3-yl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C17H15N3O2S2/c21-15(12-9-24-14-8-4-2-5-10(12)14)19-20-16(22)11-6-1-3-7-13(11)18-17(20)23/h1,3,6-7,9H,2,4-5,8H2,(H,18,23)(H,19,21)