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

Systemtic Name: 6-azanyl-2-[1-(3-bromanyl-7-chloranyl-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-[1-(3-bromo-7-chloro-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-[1-(3-bromo-7-chloro-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-[1-(3-bromo-7-chloro-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-[1-(3-bromo-7-chloro-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]pyrimidine-4-carbonitrile Formula: C14H10BrClN6S MolecularWeight: 409.6914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=C2C(=C1)C(=CN2)Br)Cl)SC3=NC(=CC(=N3)N)C#N

Isomeric SMILES

CC(C1=NC(=C2C(=C1)C(=CN2)Br)Cl)SC3=NC(=CC(=N3)N)C#N

InChI

InChI=1S/C14H10BrClN6S/c1-6(23-14-20-7(4-17)2-11(18)22-14)10-3-8-9(15)5-19-12(8)13(16)21-10/h2-3,5-6,19H,1H3,(H2,18,20,22)