1-(2-methoxy-5-methyl-phenyl)-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)-3-[2-(phenylmethylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-[(2-benzylsulfanylacetyl)amino]-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-(2-methoxy-5-methylphenyl)-3-[[1-oxo-2-(phenylmethylthio)ethyl]amino]thiourea IUPAC Name: 1-[(2-benzylsulfanylacetyl)amino]-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-[[2-(benzylthio)acetyl]amino]-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C18H21N3O2S2 MolecularWeight: 375.50824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NNC(=O)CSCC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NNC(=O)CSCC2=CC=CC=C2

InChI

InChI=1S/C18H21N3O2S2/c1-13-8-9-16(23-2)15(10-13)19-18(24)21-20-17(22)12-25-11-14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3,(H,20,22)(H2,19,21,24)