N-(5-cyclopropyl-1H-pyrazol-3-yl)-5,6-dimethyl-2-naphthalen-2-ylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-5,6-dimethyl-2-naphthalen-2-ylsulfanyl-pyrimidin-4-amine Openeye Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-5,6-dimethyl-2-(2-naphthylsulfanyl)pyrimidin-4-amine CAS Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-5,6-dimethyl-2-(2-naphthalenylthio)-4-pyrimidinamine IUPAC Name: N-(5-cyclopropyl-1H-pyrazol-3-yl)-5,6-dimethyl-2-naphthalen-2-ylsulfanylpyrimidin-4-amine Traditional Name: (5-cyclopropyl-1H-pyrazol-3-yl)-[5,6-dimethyl-2-(2-naphthylthio)pyrimidin-4-yl]amine Formula: C22H21N5S MolecularWeight: 387.50064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NC2=NNC(=C2)C3CC3)SC4=CC5=CC=CC=C5C=C4)C

Isomeric SMILES

CC1=C(N=C(N=C1NC2=NNC(=C2)C3CC3)SC4=CC5=CC=CC=C5C=C4)C

InChI

InChI=1S/C22H21N5S/c1-13-14(2)23-22(28-18-10-9-15-5-3-4-6-17(15)11-18)25-21(13)24-20-12-19(26-27-20)16-7-8-16/h3-6,9-12,16H,7-8H2,1-2H3,(H2,23,24,25,26,27)