4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine

Systemtic Name: 4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine Openeye Name: 4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine CAS Name: 4-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine IUPAC Name: 4-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine Traditional Name: 4-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine Formula: C27H19N3OS3 MolecularWeight: 497.65426

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)SC3=NC=NC4=C3C(=CS4)C5=CC=C(C=C5)C6=CC=CC=C6

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)SC3=NC=NC4=C3C(=CS4)C5=CC=C(C=C5)C6=CC=CC=C6

InChI

InChI=1S/C27H19N3OS3/c1-2-31-20-12-13-22-23(14-20)33-27(30-22)34-26-24-21(15-32-25(24)28-16-29-26)19-10-8-18(9-11-19)17-6-4-3-5-7-17/h3-16H,2H2,1H3