N-[2-(5-bromanyl-2-methoxy-phenyl)ethylcarbamothioyl]-4-methyl-benzamide

Systemtic Name: N-[2-(5-bromanyl-2-methoxy-phenyl)ethylcarbamothioyl]-4-methyl-benzamide Openeye Name: N-[2-(5-bromo-2-methoxy-phenyl)ethylcarbamothioyl]-4-methyl-benzamide CAS Name: N-[[2-(5-bromo-2-methoxyphenyl)ethylamino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[2-(5-bromo-2-methoxyphenyl)ethylcarbamothioyl]-4-methylbenzamide Traditional Name: N-[2-(5-bromo-2-methoxy-phenyl)ethylthiocarbamoyl]-4-methyl-benzamide Formula: C18H19BrN2O2S MolecularWeight: 407.32466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NCCC2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NCCC2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C18H19BrN2O2S/c1-12-3-5-13(6-4-12)17(22)21-18(24)20-10-9-14-11-15(19)7-8-16(14)23-2/h3-8,11H,9-10H2,1-2H3,(H2,20,21,22,24)