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

Systemtic Name: 6-azanyl-2-[1-(3-bromanyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-[1-(3-bromo-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-[1-(3-bromo-1-methyl-5-pyrrolo[2,3-c]pyridinyl)ethylthio]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-[1-(3-bromo-1-methylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-[1-(3-bromo-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]pyrimidine-4-carbonitrile Formula: C15H13BrN6S MolecularWeight: 389.27292

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=C2C(=C1)C(=CN2C)Br)SC3=NC(=CC(=N3)N)C#N

Isomeric SMILES

CC(C1=NC=C2C(=C1)C(=CN2C)Br)SC3=NC(=CC(=N3)N)C#N

InChI

InChI=1S/C15H13BrN6S/c1-8(23-15-20-9(5-17)3-14(18)21-15)12-4-10-11(16)7-22(2)13(10)6-19-12/h3-4,6-8H,1-2H3,(H2,18,20,21)