2-[2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanylethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanylethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]ethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]thiophene-3-carboxamide Formula: C22H18N4O3S2 MolecularWeight: 450.53332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CS4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CS4)C(=O)N

InChI

InChI=1S/C22H18N4O3S2/c23-19(28)16-10-11-30-20(16)25-18(27)13-31-22-24-17-9-5-4-8-15(17)21(29)26(22)12-14-6-2-1-3-7-14/h1-11H,12-13H2,(H2,23,28)(H,25,27)