methyl N-[[2-[2-(dimethylamino)ethanoylamino]-4-propylsulfanyl-phenyl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-[2-(dimethylamino)ethanoylamino]-4-propylsulfanyl-phenyl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-[[2-(dimethylamino)acetyl]amino]-4-propylsulfanyl-phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[[2-(dimethylamino)-1-oxoethyl]amino]-4-(propylthio)anilino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-[[2-(dimethylamino)acetyl]amino]-4-propylsulfanylphenyl]carbamothioyl]carbamate Traditional Name: N-[[2-[[2-(dimethylamino)acetyl]amino]-4-(propylthio)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C16H24N4O3S2 MolecularWeight: 384.51676

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)NC(=S)NC(=O)OC)NC(=O)CN(C)C

Isomeric SMILES

CCCSC1=CC(=C(C=C1)NC(=S)NC(=O)OC)NC(=O)CN(C)C

InChI

InChI=1S/C16H24N4O3S2/c1-5-8-25-11-6-7-12(18-15(24)19-16(22)23-4)13(9-11)17-14(21)10-20(2)3/h6-7,9H,5,8,10H2,1-4H3,(H,17,21)(H2,18,19,22,24)