6-azanyl-2-[1-(3-bromanyl-7-chloranyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile

Systemtic Name: 6-azanyl-2-[1-(3-bromanyl-7-chloranyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-[1-(3-bromo-7-chloro-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-[1-(3-bromo-7-chloro-1-methyl-5-pyrrolo[2,3-c]pyridinyl)ethylthio]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-[1-(3-bromo-7-chloro-1-methylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-[1-(3-bromo-7-chloro-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]pyrimidine-4-carbonitrile Formula: C15H12BrClN6S MolecularWeight: 423.71798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12BrClN6S/c1-7(24-15-20-8(5-18)3-12(19)22-15)11-4-9-10(16)6-23(2)13(9)14(17)21-11/h3-4,6-7H,1-2H3,(H2,19,20,22)