5-azanyl-1-[6-(3,5-dimethylphenyl)thieno[3,2-d]pyrimidin-4-yl]pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[6-(3,5-dimethylphenyl)thieno[3,2-d]pyrimidin-4-yl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(3,5-dimethylphenyl)thieno[3,2-d]pyrimidin-4-yl]pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(3,5-dimethylphenyl)-4-thieno[3,2-d]pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(3,5-dimethylphenyl)thieno[3,2-d]pyrimidin-4-yl]pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(3,5-dimethylphenyl)thieno[3,2-d]pyrimidin-4-yl]pyrazole-4-carbonitrile Formula: C18H14N6S MolecularWeight: 346.40896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=CC3=C(S2)C(=NC=N3)N4C(=C(C=N4)C#N)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=CC3=C(S2)C(=NC=N3)N4C(=C(C=N4)C#N)N)C

InChI

InChI=1S/C18H14N6S/c1-10-3-11(2)5-12(4-10)15-6-14-16(25-15)18(22-9-21-14)24-17(20)13(7-19)8-23-24/h3-6,8-9H,20H2,1-2H3