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

Systemtic Name: 6-azanyl-2-[1-(7-chloranyl-3-ethyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-[1-(7-chloro-3-ethyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-[1-(7-chloro-3-ethyl-1-methyl-5-pyrrolo[2,3-c]pyridinyl)ethylthio]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-[1-(7-chloro-3-ethyl-1-methylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-[1-(7-chloro-3-ethyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]pyrimidine-4-carbonitrile Formula: C17H17ClN6S MolecularWeight: 372.87508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C2=C(N=C(C=C12)C(C)SC3=NC(=CC(=N3)N)C#N)Cl)C

Isomeric SMILES

CCC1=CN(C2=C(N=C(C=C12)C(C)SC3=NC(=CC(=N3)N)C#N)Cl)C

InChI

InChI=1S/C17H17ClN6S/c1-4-10-8-24(3)15-12(10)6-13(22-16(15)18)9(2)25-17-21-11(7-19)5-14(20)23-17/h5-6,8-9H,4H2,1-3H3,(H2,20,21,23)