4-[2-azanyl-5-(2,4-dichlorophenyl)sulfanyl-pyrimidin-4-yl]cyclohexan-1-one

Systemtic Name: 4-[2-azanyl-5-(2,4-dichlorophenyl)sulfanyl-pyrimidin-4-yl]cyclohexan-1-one Openeye Name: 4-[2-amino-5-(2,4-dichlorophenyl)sulfanyl-pyrimidin-4-yl]cyclohexanone CAS Name: 4-[2-amino-5-[(2,4-dichlorophenyl)thio]-4-pyrimidinyl]-1-cyclohexanone IUPAC Name: 4-[2-amino-5-(2,4-dichlorophenyl)sulfanylpyrimidin-4-yl]cyclohexan-1-one Traditional Name: 4-[2-amino-5-[(2,4-dichlorophenyl)thio]pyrimidin-4-yl]cyclohexanone Formula: C16H15Cl2N3OS MolecularWeight: 368.2808

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)CCC1C2=NC(=NC=C2SC3=C(C=C(C=C3)Cl)Cl)N

Isomeric SMILES

C1CC(=O)CCC1C2=NC(=NC=C2SC3=C(C=C(C=C3)Cl)Cl)N

InChI

InChI=1S/C16H15Cl2N3OS/c17-10-3-6-13(12(18)7-10)23-14-8-20-16(19)21-15(14)9-1-4-11(22)5-2-9/h3,6-9H,1-2,4-5H2,(H2,19,20,21)