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

Systemtic Name: 6-azanyl-2-[1-(3-cyclopropyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-[1-(3-cyclopropyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-[1-(3-cyclopropyl-1-methyl-5-pyrrolo[2,3-c]pyridinyl)ethylthio]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-[1-(3-cyclopropyl-1-methylpyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-[1-(3-cyclopropyl-1-methyl-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]pyrimidine-4-carbonitrile Formula: C18H18N6S MolecularWeight: 350.44072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=C2C(=C1)C(=CN2C)C3CC3)SC4=NC(=CC(=N4)N)C#N

Isomeric SMILES

CC(C1=NC=C2C(=C1)C(=CN2C)C3CC3)SC4=NC(=CC(=N4)N)C#N

InChI

InChI=1S/C18H18N6S/c1-10(25-18-22-12(7-19)5-17(20)23-18)15-6-13-14(11-3-4-11)9-24(2)16(13)8-21-15/h5-6,8-11H,3-4H2,1-2H3,(H2,20,22,23)