6-azanyl-2-[1-(1,2-dimethylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile

Systemtic Name: 6-azanyl-2-[1-(1,2-dimethylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-[1-(1,2-dimethylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-[1-(1,2-dimethyl-5-pyrrolo[2,3-c]pyridinyl)ethylthio]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-[1-(1,2-dimethylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-[1-(1,2-dimethylpyrrolo[2,3-c]pyridin-5-yl)ethylthio]pyrimidine-4-carbonitrile Formula: C16H16N6S MolecularWeight: 324.40344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=NC=C2N1C)C(C)SC3=NC(=CC(=N3)N)C#N

Isomeric SMILES

CC1=CC2=CC(=NC=C2N1C)C(C)SC3=NC(=CC(=N3)N)C#N

InChI

InChI=1S/C16H16N6S/c1-9-4-11-5-13(19-8-14(11)22(9)3)10(2)23-16-20-12(7-17)6-15(18)21-16/h4-6,8,10H,1-3H3,(H2,18,20,21)