[2-chloranyl-4-[(2-chloranyl-5-oxidanyl-cyclohexa-1,5-dien-1-yl)carbamothioylamino]-5-methoxy-phenyl] carbamate

Systemtic Name: [2-chloranyl-4-[(2-chloranyl-5-oxidanyl-cyclohexa-1,5-dien-1-yl)carbamothioylamino]-5-methoxy-phenyl] carbamate Openeye Name: [2-chloro-4-[(2-chloro-5-hydroxy-cyclohexa-1,5-dien-1-yl)carbamothioylamino]-5-methoxy-phenyl] carbamate CAS Name: carbamic acid [2-chloro-4-[[[(2-chloro-5-hydroxy-1-cyclohexa-1,5-dienyl)amino]-sulfanylidenemethyl]amino]-5-methoxyphenyl] ester IUPAC Name: [2-chloro-4-[(2-chloro-5-hydroxycyclohexa-1,5-dien-1-yl)carbamothioylamino]-5-methoxyphenyl] carbamate Traditional Name: carbamic acid [2-chloro-4-[(2-chloro-5-hydroxy-cyclohexa-1,5-dien-1-yl)thiocarbamoylamino]-5-methoxy-phenyl] ester Formula: C15H15Cl2N3O4S MolecularWeight: 404.2683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)NC2=C(CCC(=C2)O)Cl)Cl)OC(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)NC2=C(CCC(=C2)O)Cl)Cl)OC(=O)N

InChI

InChI=1S/C15H15Cl2N3O4S/c1-23-13-6-12(24-14(18)22)9(17)5-11(13)20-15(25)19-10-4-7(21)2-3-8(10)16/h4-6,21H,2-3H2,1H3,(H2,18,22)(H2,19,20,25)