2-[1-(3-tert-butyl-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-chloranyl-pyrimidin-4-amine

Systemtic Name: 2-[1-(3-tert-butyl-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-chloranyl-pyrimidin-4-amine Openeye Name: 2-[1-(3-tert-butyl-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-chloro-pyrimidin-4-amine CAS Name: 2-[1-(3-tert-butyl-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]-6-chloro-4-pyrimidinamine IUPAC Name: 2-[1-(3-tert-butyl-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylsulfanyl]-6-chloropyrimidin-4-amine Traditional Name: [2-[1-(3-tert-butyl-1H-pyrrolo[2,3-c]pyridin-5-yl)ethylthio]-6-chloro-pyrimidin-4-yl]amine Formula: C17H20ClN5S MolecularWeight: 361.8922

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20ClN5S/c1-9(24-16-22-14(18)6-15(19)23-16)12-5-10-11(17(2,3)4)7-20-13(10)8-21-12/h5-9,20H,1-4H3,(H2,19,22,23)