1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-(thiophen-2-ylmethylsulfanyl)ethanoylamino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[2-(2-thienylmethylsulfanyl)acetyl]amino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[1-oxo-2-(thiophen-2-ylmethylthio)ethyl]amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[2-(thiophen-2-ylmethylsulfanyl)acetyl]amino]thiourea Traditional Name: 1-homoveratryl-3-[[2-(2-thenylthio)acetyl]amino]thiourea Formula: C18H23N3O3S3 MolecularWeight: 425.58852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)CSCC2=CC=CS2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)CSCC2=CC=CS2)OC

InChI

InChI=1S/C18H23N3O3S3/c1-23-15-6-5-13(10-16(15)24-2)7-8-19-18(25)21-20-17(22)12-26-11-14-4-3-9-27-14/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,20,22)(H2,19,21,25)