2-[5-[(3-chlorophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-propan-2-yl-ethanamide

Systemtic Name: 2-[5-[(3-chlorophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-propan-2-yl-ethanamide Openeye Name: 2-[5-[(3-chlorophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-isopropyl-acetamide CAS Name: 2-[[5-[(3-chlorophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-propan-2-ylacetamide IUPAC Name: 2-[5-[(3-chlorophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-propan-2-ylacetamide Traditional Name: 2-[[5-(3-chlorobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-isopropyl-acetamide Formula: C18H22ClN3O2S MolecularWeight: 379.90418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCC(=O)NC(C)C)C)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCC(=O)NC(C)C)C)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H22ClN3O2S/c1-11(2)20-16(23)10-25-18-21-12(3)15(17(24)22(18)4)9-13-6-5-7-14(19)8-13/h5-8,11H,9-10H2,1-4H3,(H,20,23)