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

Systemtic Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide Openeye Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(5-oxo-3-thioxo-2H-1,2,4-triazin-6-yl)propanamide CAS Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide IUPAC Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(5-oxo-3-sulfanylidene-2H-1,2,4-triazin-6-yl)propanamide Traditional Name: N-[(1S)-1-(2-bromophenyl)ethyl]-3-(5-keto-3-thioxo-2H-1,2,4-triazin-6-yl)propionamide Formula: C14H15BrN4O2S MolecularWeight: 383.2635

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC(=O)CCC2=NNC(=S)NC2=O

Isomeric SMILES

C[C@@H](C1=CC=CC=C1Br)NC(=O)CCC2=NNC(=S)NC2=O

InChI

InChI=1S/C14H15BrN4O2S/c1-8(9-4-2-3-5-10(9)15)16-12(20)7-6-11-13(21)17-14(22)19-18-11/h2-5,8H,6-7H2,1H3,(H,16,20)(H2,17,19,21,22)/t8-/m0/s1