7-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-3-ethyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonyl-3-ethyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-ethyl-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]-3-ethyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-ethyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-ethyl-2-thioxo-1H-quinazolin-4-one Formula: C23H22N4O2S2 MolecularWeight: 450.57638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4)NC1=S

InChI

InChI=1S/C23H22N4O2S2/c1-2-27-22(29)16-8-7-15(13-18(16)25-23(27)30)21(28)26-11-9-14(10-12-26)20-24-17-5-3-4-6-19(17)31-20/h3-8,13-14H,2,9-12H2,1H3,(H,25,30)