2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-phenyl-1,2-dihydroquinazoline-4-thione

Systemtic Name: 2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-phenyl-1,2-dihydroquinazoline-4-thione Openeye Name: 2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]-3-phenyl-1,2-dihydroquinazoline-4-thione CAS Name: 2-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxyphenyl]-3-phenyl-1,2-dihydroquinazoline-4-thione IUPAC Name: 2-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]-3-phenyl-1,2-dihydroquinazoline-4-thione Traditional Name: 2-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxy-phenyl]-3-phenyl-1,2-dihydroquinazoline-4-thione Formula: C29H23N3OS3 MolecularWeight: 525.70742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H23N3OS3/c1-33-25-16-15-19(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(34)32(27)21-9-3-2-4-10-21/h2-17,27,30H,18H2,1H3