2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-phenyl-1,2-dihydroquinazolin-4-one

Systemtic Name: 2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-phenyl-1,2-dihydroquinazolin-4-one Openeye Name: 2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-phenyl-1,2-dihydroquinazolin-4-one CAS Name: 2-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxyphenyl]-3-phenyl-1,2-dihydroquinazolin-4-one IUPAC Name: 2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]-3-phenyl-1,2-dihydroquinazolin-4-one Traditional Name: 2-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxy-phenyl]-3-phenyl-1,2-dihydroquinazolin-4-one Formula: C29H23N3O2S2 MolecularWeight: 509.64182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)CSC5=NC6=CC=CC=C6S5

Isomeric SMILES

COC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4)CSC5=NC6=CC=CC=C6S5

InChI

InChI=1S/C29H23N3O2S2/c1-34-25-16-15-19(17-20(25)18-35-29-31-24-13-7-8-14-26(24)36-29)27-30-23-12-6-5-11-22(23)28(33)32(27)21-9-3-2-4-10-21/h2-17,27,30H,18H2,1H3