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

Systemtic Name: methyl N-[[2-(methoxycarbonylcarbamothioylamino)-4-prop-2-enylsulfinyl-phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[4-allylsulfinyl-2-(methoxycarbonylcarbamothioylamino)phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[[(methoxycarbonylamino)-sulfanylidenemethyl]amino]-4-prop-2-enylsulfinylanilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(methoxycarbonylcarbamothioylamino)-4-prop-2-enylsulfinylphenyl]carbamothioyl]carbamate Traditional Name: N-[[4-allylsulfinyl-2-(carbomethoxythiocarbamoylamino)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C15H18N4O5S3 MolecularWeight: 430.52222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N4O5S3/c1-4-7-27(22)9-5-6-10(16-12(25)18-14(20)23-2)11(8-9)17-13(26)19-15(21)24-3/h4-6,8H,1,7H2,2-3H3,(H2,16,18,20,25)(H2,17,19,21,26)