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

Systemtic Name: 6-azanyl-2-[1-[3-(dimethylaminomethyl)-1-methyl-pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-[1-[3-(dimethylaminomethyl)-1-methyl-pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-[1-[3-(dimethylaminomethyl)-1-methyl-5-pyrrolo[2,3-c]pyridinyl]ethylthio]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-[1-[3-(dimethylaminomethyl)-1-methylpyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-[1-[3-(dimethylaminomethyl)-1-methyl-pyrrolo[2,3-c]pyridin-5-yl]ethylthio]pyrimidine-4-carbonitrile Formula: C18H21N7S MolecularWeight: 367.47124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N7S/c1-11(26-18-22-13(7-19)5-17(20)23-18)15-6-14-12(9-24(2)3)10-25(4)16(14)8-21-15/h5-6,8,10-11H,9H2,1-4H3,(H2,20,22,23)