4-(benzotriazol-1-yl)-5-(3,4-dimethoxyphenyl)-2-methyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-(benzotriazol-1-yl)-5-(3,4-dimethoxyphenyl)-2-methyl-thieno[2,3-d]pyrimidine Openeye Name: 4-(benzotriazol-1-yl)-5-(3,4-dimethoxyphenyl)-2-methyl-thieno[2,3-d]pyrimidine CAS Name: 4-(1-benzotriazolyl)-5-(3,4-dimethoxyphenyl)-2-methylthieno[2,3-d]pyrimidine IUPAC Name: 4-(benzotriazol-1-yl)-5-(3,4-dimethoxyphenyl)-2-methylthieno[2,3-d]pyrimidine Traditional Name: 4-(benzotriazol-1-yl)-5-(3,4-dimethoxyphenyl)-2-methyl-thieno[2,3-d]pyrimidine Formula: C21H17N5O2S MolecularWeight: 403.45698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=CSC2=N1)C3=CC(=C(C=C3)OC)OC)N4C5=CC=CC=C5N=N4

Isomeric SMILES

CC1=NC(=C2C(=CSC2=N1)C3=CC(=C(C=C3)OC)OC)N4C5=CC=CC=C5N=N4

InChI

InChI=1S/C21H17N5O2S/c1-12-22-20(26-16-7-5-4-6-15(16)24-25-26)19-14(11-29-21(19)23-12)13-8-9-17(27-2)18(10-13)28-3/h4-11H,1-3H3