2-(3,4-dimethoxyphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carbonitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carbonitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carbonitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5-methyl-4-(4-methyl-1-piperazinyl)-6-thieno[2,3-d]pyrimidinecarbonitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5-methyl-4-(4-methylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carbonitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-5-methyl-4-(4-methylpiperazino)thieno[2,3-d]pyrimidine-6-carbonitrile Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C)C4=CC(=C(C=C4)OC)OC)C#N

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CCN(CC3)C)C4=CC(=C(C=C4)OC)OC)C#N

InChI

InChI=1S/C21H23N5O2S/c1-13-17(12-22)29-21-18(13)20(26-9-7-25(2)8-10-26)23-19(24-21)14-5-6-15(27-3)16(11-14)28-4/h5-6,11H,7-10H2,1-4H3