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

Systemtic Name: 6-azanyl-2-[1-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-[1-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-[1-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-c]pyridin-5-yl]ethylthio]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-[1-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-c]pyridin-5-yl]ethylsulfanyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-[1-[3-(dimethylaminomethyl)-1H-pyrrolo[2,3-c]pyridin-5-yl]ethylthio]pyrimidine-4-carbonitrile Formula: C17H19N7S MolecularWeight: 353.44466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N7S/c1-10(25-17-22-12(6-18)4-16(19)23-17)14-5-13-11(9-24(2)3)7-20-15(13)8-21-14/h4-5,7-8,10,20H,9H2,1-3H3,(H2,19,22,23)