[5-[[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl-dimethyl-azanium

Systemtic Name: [5-[[(3-chloranyl-2-methyl-phenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl-dimethyl-azanium Openeye Name: [5-[[(3-chloro-2-methyl-phenyl)carbamothioylamino]carbamoyl]-2-furyl]methyl-dimethyl-ammonium CAS Name: [5-[[[(3-chloro-2-methylanilino)-sulfanylidenemethyl]hydrazo]-oxomethyl]-2-furanyl]methyl-dimethylammonium IUPAC Name: [5-[[(3-chloro-2-methylphenyl)carbamothioylamino]carbamoyl]furan-2-yl]methyl-dimethylazanium Traditional Name: [5-[[(3-chloro-2-methyl-phenyl)thiocarbamoylamino]carbamoyl]-2-furyl]methyl-dimethyl-ammonium Formula: C16H20ClN4O2S+ MolecularWeight: 367.8736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)C2=CC=C(O2)C[NH+](C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=O)C2=CC=C(O2)C[NH+](C)C

InChI

InChI=1S/C16H19ClN4O2S/c1-10-12(17)5-4-6-13(10)18-16(24)20-19-15(22)14-8-7-11(23-14)9-21(2)3/h4-8H,9H2,1-3H3,(H,19,22)(H2,18,20,24)/p+1