3-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(5-morpholinosulfonyl-2-thienyl)methyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[[5-(4-morpholinylsulfonyl)-2-thiophenyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(5-morpholin-4-ylsulfonylthiophen-2-yl)methyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[(5-morpholinosulfonyl-2-thienyl)methyl]-2-thioxo-1H-quinazolin-4-one Formula: C17H17N3O4S3 MolecularWeight: 423.52958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(S2)CN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(S2)CN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C17H17N3O4S3/c21-16-13-3-1-2-4-14(13)18-17(25)20(16)11-12-5-6-15(26-12)27(22,23)19-7-9-24-10-8-19/h1-6H,7-11H2,(H,18,25)