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

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanamide Openeye Name: N-[1-(3-bromophenyl)ethyl]-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide CAS Name: N-[1-(3-bromophenyl)ethyl]-3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-[1-(3-bromophenyl)ethyl]-3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanamide Traditional Name: N-[1-(3-bromophenyl)ethyl]-3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]propionamide Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NC(C)C2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NC(C)C2=CC(=CC=C2)Br

InChI

InChI=1S/C17H20BrN3O2S/c1-10(12-5-4-6-13(18)9-12)19-15(22)8-7-14-11(2)20-17(24-3)21-16(14)23/h4-6,9-10H,7-8H2,1-3H3,(H,19,22)(H,20,21,23)