N-[(1S)-1-(2-bromophenyl)ethyl]-3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide

Systemtic Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(6-methyl-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(6-methyl-4-oxo-2-thioxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide IUPAC Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(6-methyl-4-oxo-2-sulfanylidene-1H-pyrimidin-5-yl)propanamide Traditional Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(4-keto-6-methyl-2-thioxo-1H-pyrimidin-5-yl)propionamide Formula: C16H18BrN3O2S MolecularWeight: 396.30202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=S)N1)CCC(=O)NC(C)C2=CC=CC=C2Br

Isomeric SMILES

CC1=C(C(=O)NC(=S)N1)CCC(=O)N[C@@H](C)C2=CC=CC=C2Br

InChI

InChI=1S/C16H18BrN3O2S/c1-9(11-5-3-4-6-13(11)17)18-14(21)8-7-12-10(2)19-16(23)20-15(12)22/h3-6,9H,7-8H2,1-2H3,(H,18,21)(H2,19,20,22,23)/t9-/m0/s1