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

Systemtic Name: 4-(2,3-dihydroindol-1-yl)-5,6-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine Openeye Name: 4-indolin-1-yl-5,6-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine CAS Name: 4-(2,3-dihydroindol-1-yl)-5,6-dimethyl-2-(1-pyrrolidin-1-iumylmethyl)thieno[2,3-d]pyrimidine IUPAC Name: 4-(2,3-dihydroindol-1-yl)-5,6-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine Traditional Name: 4-indolin-1-yl-5,6-dimethyl-2-(pyrrolidin-1-ium-1-ylmethyl)thieno[2,3-d]pyrimidine Formula: C21H25N4S+ MolecularWeight: 365.515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCC4=CC=CC=C43)C[NH+]5CCCC5)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCC4=CC=CC=C43)C[NH+]5CCCC5)C

InChI

InChI=1S/C21H24N4S/c1-14-15(2)26-21-19(14)20(22-18(23-21)13-24-10-5-6-11-24)25-12-9-16-7-3-4-8-17(16)25/h3-4,7-8H,5-6,9-13H2,1-2H3/p+1