5,6-dimethyl-2-[(4-methylpiperidin-1-yl)methyl]-4-(2-nitrophenoxy)thieno[2,3-d]pyrimidine

Systemtic Name: 5,6-dimethyl-2-[(4-methylpiperidin-1-yl)methyl]-4-(2-nitrophenoxy)thieno[2,3-d]pyrimidine Openeye Name: 5,6-dimethyl-2-[(4-methyl-1-piperidyl)methyl]-4-(2-nitrophenoxy)thieno[2,3-d]pyrimidine CAS Name: 5,6-dimethyl-2-[(4-methyl-1-piperidinyl)methyl]-4-(2-nitrophenoxy)thieno[2,3-d]pyrimidine IUPAC Name: 5,6-dimethyl-2-[(4-methylpiperidin-1-yl)methyl]-4-(2-nitrophenoxy)thieno[2,3-d]pyrimidine Traditional Name: 5,6-dimethyl-2-[(4-methylpiperidino)methyl]-4-(2-nitrophenoxy)thieno[2,3-d]pyrimidine Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC2=NC(=C3C(=C(SC3=N2)C)C)OC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)CC2=NC(=C3C(=C(SC3=N2)C)C)OC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O3S/c1-13-8-10-24(11-9-13)12-18-22-20(19-14(2)15(3)29-21(19)23-18)28-17-7-5-4-6-16(17)25(26)27/h4-7,13H,8-12H2,1-3H3