[4-bromanyl-2-[2-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)ethyl]phenyl] carbamate

Systemtic Name: [4-bromanyl-2-[2-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)ethyl]phenyl] carbamate Openeye Name: [4-bromo-2-[2-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)ethyl]phenyl] carbamate CAS Name: carbamic acid [4-bromo-2-[2-[[(1-cyclohexa-1,5-dienylamino)-sulfanylidenemethyl]amino]ethyl]phenyl] ester IUPAC Name: [4-bromo-2-[2-(cyclohexa-1,5-dien-1-ylcarbamothioylamino)ethyl]phenyl] carbamate Traditional Name: carbamic acid [4-bromo-2-[2-(cyclohexa-1,5-dien-1-ylthiocarbamoylamino)ethyl]phenyl] ester Formula: C16H18BrN3O2S MolecularWeight: 396.30202

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C=C1)NC(=S)NCCC2=C(C=CC(=C2)Br)OC(=O)N

Isomeric SMILES

C1CC=C(C=C1)NC(=S)NCCC2=C(C=CC(=C2)Br)OC(=O)N

InChI

InChI=1S/C16H18BrN3O2S/c17-12-6-7-14(22-15(18)21)11(10-12)8-9-19-16(23)20-13-4-2-1-3-5-13/h2,4-7,10H,1,3,8-9H2,(H2,18,21)(H2,19,20,23)