1-[2-(3,4-dimethoxyphenyl)ethanoylamino]-3-(3-methylsulfanylphenyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethanoylamino]-3-(3-methylsulfanylphenyl)thiourea Openeye Name: 1-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-3-(3-methylsulfanylphenyl)thiourea CAS Name: 1-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]-3-[3-(methylthio)phenyl]thiourea IUPAC Name: 1-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-3-(3-methylsulfanylphenyl)thiourea Traditional Name: 1-(homoveratroylamino)-3-[3-(methylthio)phenyl]thiourea Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NNC(=S)NC2=CC(=CC=C2)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NNC(=S)NC2=CC(=CC=C2)SC)OC

InChI

InChI=1S/C18H21N3O3S2/c1-23-15-8-7-12(9-16(15)24-2)10-17(22)20-21-18(25)19-13-5-4-6-14(11-13)26-3/h4-9,11H,10H2,1-3H3,(H,20,22)(H2,19,21,25)