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

Systemtic Name: 5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carbonitrile Openeye Name: 5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carbonitrile CAS Name: 5-methyl-4-(4-methyl-1-piperazin-4-iumyl)-2-phenyl-6-thieno[2,3-d]pyrimidinecarbonitrile IUPAC Name: 5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenylthieno[2,3-d]pyrimidine-6-carbonitrile Traditional Name: 5-methyl-4-(4-methylpiperazin-4-ium-1-yl)-2-phenyl-thieno[2,3-d]pyrimidine-6-carbonitrile Formula: C19H20N5S+ MolecularWeight: 350.4606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N3CC[NH+](CC3)C)C4=CC=CC=C4)C#N

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N3CC[NH+](CC3)C)C4=CC=CC=C4)C#N

InChI

InChI=1S/C19H19N5S/c1-13-15(12-20)25-19-16(13)18(24-10-8-23(2)9-11-24)21-17(22-19)14-6-4-3-5-7-14/h3-7H,8-11H2,1-2H3/p+1