N-[(5-chloranylthiophen-2-yl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C14H10ClN3O2S2 MolecularWeight: 351.8311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)NCC3=CC=C(S3)Cl)NC(=S)NC2=O

Isomeric SMILES

C1=CC2=C(C=C1C(=O)NCC3=CC=C(S3)Cl)NC(=S)NC2=O

InChI

InChI=1S/C14H10ClN3O2S2/c15-11-4-2-8(22-11)6-16-12(19)7-1-3-9-10(5-7)17-14(21)18-13(9)20/h1-5H,6H2,(H,16,19)(H2,17,18,20,21)