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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)N4C(=C(C=N4)C#N)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC3=NC=NC(=C23)N4C(=C(C=N4)C#N)N)C

InChI

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