(4-phenyl-2-pyrimidin-2-ylsulfanyl-cyclohexyl)methanamine

Systemtic Name: (4-phenyl-2-pyrimidin-2-ylsulfanyl-cyclohexyl)methanamine Openeye Name: (4-phenyl-2-pyrimidin-2-ylsulfanyl-cyclohexyl)methanamine CAS Name: [4-phenyl-2-(2-pyrimidinylthio)cyclohexyl]methanamine IUPAC Name: (4-phenyl-2-pyrimidin-2-ylsulfanylcyclohexyl)methanamine Traditional Name: [4-phenyl-2-(2-pyrimidylthio)cyclohexyl]methylamine Formula: C17H21N3S MolecularWeight: 299.43374

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1C2=CC=CC=C2)SC3=NC=CC=N3)CN

Isomeric SMILES

C1CC(C(CC1C2=CC=CC=C2)SC3=NC=CC=N3)CN

InChI

InChI=1S/C17H21N3S/c18-12-15-8-7-14(13-5-2-1-3-6-13)11-16(15)21-17-19-9-4-10-20-17/h1-6,9-10,14-16H,7-8,11-12,18H2