methyl N-[[2-(methoxycarbonylcarbamothioylamino)-4-(methylsulfanylmethoxy)phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-(methoxycarbonylcarbamothioylamino)-4-(methylsulfanylmethoxy)phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-(methoxycarbonylcarbamothioylamino)-4-(methylsulfanylmethoxy)phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[[(methoxycarbonylamino)-sulfanylidenemethyl]amino]-4-[(methylthio)methoxy]anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(methoxycarbonylcarbamothioylamino)-4-(methylsulfanylmethoxy)phenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(carbomethoxythiocarbamoylamino)-4-[(methylthio)methoxy]phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C14H18N4O5S3 MolecularWeight: 418.51152

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C=C(C=C1)OCSC)NC(=S)NC(=O)OC

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C=C(C=C1)OCSC)NC(=S)NC(=O)OC

InChI

InChI=1S/C14H18N4O5S3/c1-21-13(19)17-11(24)15-9-5-4-8(23-7-26-3)6-10(9)16-12(25)18-14(20)22-2/h4-6H,7H2,1-3H3,(H2,15,17,19,24)(H2,16,18,20,25)