3-(4-tert-butyl-2-sulfanylidene-1H-pyrimidin-6-yl)-N-(4-chlorophenyl)propanamide

Systemtic Name: 3-(4-tert-butyl-2-sulfanylidene-1H-pyrimidin-6-yl)-N-(4-chlorophenyl)propanamide Openeye Name: 3-(4-tert-butyl-2-thioxo-1H-pyrimidin-6-yl)-N-(4-chlorophenyl)propanamide CAS Name: 3-(4-tert-butyl-2-sulfanylidene-1H-pyrimidin-6-yl)-N-(4-chlorophenyl)propanamide IUPAC Name: 3-(4-tert-butyl-2-sulfanylidene-1H-pyrimidin-6-yl)-N-(4-chlorophenyl)propanamide Traditional Name: 3-(4-tert-butyl-2-thioxo-1H-pyrimidin-6-yl)-N-(4-chlorophenyl)propionamide Formula: C17H20ClN3OS MolecularWeight: 349.8782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=S)NC(=C1)CCC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)C1=NC(=S)NC(=C1)CCC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H20ClN3OS/c1-17(2,3)14-10-13(20-16(23)21-14)8-9-15(22)19-12-6-4-11(18)5-7-12/h4-7,10H,8-9H2,1-3H3,(H,19,22)(H,20,21,23)