4-(5,6-dimethylbenzotriazol-1-yl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidine

Systemtic Name: 4-(5,6-dimethylbenzotriazol-1-yl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidine Openeye Name: 4-(5,6-dimethylbenzotriazol-1-yl)-5-(p-tolyl)thieno[2,3-d]pyrimidine CAS Name: 4-(5,6-dimethyl-1-benzotriazolyl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidine IUPAC Name: 4-(5,6-dimethylbenzotriazol-1-yl)-5-(4-methylphenyl)thieno[2,3-d]pyrimidine Traditional Name: 4-(5,6-dimethylbenzotriazol-1-yl)-5-(p-tolyl)thieno[2,3-d]pyrimidine Formula: C21H17N5S MolecularWeight: 371.45818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4C5=C(C=C(C(=C5)C)C)N=N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=NC=NC(=C23)N4C5=C(C=C(C(=C5)C)C)N=N4

InChI

InChI=1S/C21H17N5S/c1-12-4-6-15(7-5-12)16-10-27-21-19(16)20(22-11-23-21)26-18-9-14(3)13(2)8-17(18)24-25-26/h4-11H,1-3H3