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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=O)CCC2=C(NC(=S)NC2=O)C

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)Br)NC(=O)CCC2=C(NC(=S)NC2=O)C

InChI

InChI=1S/C17H20BrN3O2S/c1-3-14(11-4-6-12(18)7-5-11)20-15(22)9-8-13-10(2)19-17(24)21-16(13)23/h4-7,14H,3,8-9H2,1-2H3,(H,20,22)(H2,19,21,23,24)/t14-/m0/s1