2-(6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidin-4-yl)benzenecarbonitrile

Systemtic Name: 2-(6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidin-4-yl)benzenecarbonitrile Openeye Name: 2-(6-methyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidin-4-yl)benzonitrile CAS Name: 2-[6-methyl-2-(1-piperazinyl)-4-thieno[2,3-d]pyrimidinyl]benzonitrile IUPAC Name: 2-(6-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-yl)benzonitrile Traditional Name: 2-(6-methyl-2-piperazino-thieno[2,3-d]pyrimidin-4-yl)benzonitrile Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(N=C(N=C2S1)N3CCNCC3)C4=CC=CC=C4C#N

Isomeric SMILES

CC1=CC2=C(N=C(N=C2S1)N3CCNCC3)C4=CC=CC=C4C#N

InChI

InChI=1S/C18H17N5S/c1-12-10-15-16(14-5-3-2-4-13(14)11-19)21-18(22-17(15)24-12)23-8-6-20-7-9-23/h2-5,10,20H,6-9H2,1H3