N-[(5-chloranylthiophen-2-yl)methyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C19H20ClN3O2S2 MolecularWeight: 421.964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCCCCC(=O)NCC3=CC=C(S3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCCCCC(=O)NCC3=CC=C(S3)Cl

InChI

InChI=1S/C19H20ClN3O2S2/c20-16-10-9-13(27-16)12-21-17(24)8-2-1-5-11-23-18(25)14-6-3-4-7-15(14)22-19(23)26/h3-4,6-7,9-10H,1-2,5,8,11-12H2,(H,21,24)(H,22,26)