2-[4-(3,3-dimethylbutyl)phenyl]sulfanyl-5,6-dimethyl-pyrimidin-4-amine

Systemtic Name: 2-[4-(3,3-dimethylbutyl)phenyl]sulfanyl-5,6-dimethyl-pyrimidin-4-amine Openeye Name: 2-[4-(3,3-dimethylbutyl)phenyl]sulfanyl-5,6-dimethyl-pyrimidin-4-amine CAS Name: 2-[[4-(3,3-dimethylbutyl)phenyl]thio]-5,6-dimethyl-4-pyrimidinamine IUPAC Name: 2-[4-(3,3-dimethylbutyl)phenyl]sulfanyl-5,6-dimethylpyrimidin-4-amine Traditional Name: [2-[[4-(3,3-dimethylbutyl)phenyl]thio]-5,6-dimethyl-pyrimidin-4-yl]amine Formula: C18H25N3S MolecularWeight: 315.4762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N)SC2=CC=C(C=C2)CCC(C)(C)C)C

Isomeric SMILES

CC1=C(N=C(N=C1N)SC2=CC=C(C=C2)CCC(C)(C)C)C

InChI

InChI=1S/C18H25N3S/c1-12-13(2)20-17(21-16(12)19)22-15-8-6-14(7-9-15)10-11-18(3,4)5/h6-9H,10-11H2,1-5H3,(H2,19,20,21)