4-(benzotriazol-1-yl)-5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)thieno[2,3-d]pyrimidine

Systemtic Name: 4-(benzotriazol-1-yl)-5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)thieno[2,3-d]pyrimidine Openeye Name: 4-(benzotriazol-1-yl)-5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)thieno[2,3-d]pyrimidine CAS Name: 4-(1-benzotriazolyl)-5,6-dimethyl-2-(1-pyrrolidinylmethyl)thieno[2,3-d]pyrimidine IUPAC Name: 4-(benzotriazol-1-yl)-5,6-dimethyl-2-(pyrrolidin-1-ylmethyl)thieno[2,3-d]pyrimidine Traditional Name: 4-(benzotriazol-1-yl)-5,6-dimethyl-2-(pyrrolidinomethyl)thieno[2,3-d]pyrimidine Formula: C19H20N6S MolecularWeight: 364.4673

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3C4=CC=CC=C4N=N3)CN5CCCC5)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3C4=CC=CC=C4N=N3)CN5CCCC5)C

InChI

InChI=1S/C19H20N6S/c1-12-13(2)26-19-17(12)18(20-16(21-19)11-24-9-5-6-10-24)25-15-8-4-3-7-14(15)22-23-25/h3-4,7-8H,5-6,9-11H2,1-2H3