1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-phenylsulfanylethanoylamino)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-phenylsulfanylethanoylamino)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-phenylsulfanylacetyl)amino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[[1-oxo-2-(phenylthio)ethyl]amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-phenylsulfanylacetyl)amino]thiourea Traditional Name: 1-homoveratryl-3-[[2-(phenylthio)acetyl]amino]thiourea Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)CSC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NNC(=O)CSC2=CC=CC=C2)OC

InChI

InChI=1S/C19H23N3O3S2/c1-24-16-9-8-14(12-17(16)25-2)10-11-20-19(26)22-21-18(23)13-27-15-6-4-3-5-7-15/h3-9,12H,10-11,13H2,1-2H3,(H,21,23)(H2,20,22,26)