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

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethanoylamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiourea CAS Name: 1-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[[2-(3,4-dimethoxyphenyl)acetyl]amino]thiourea Traditional Name: 1-benzyl-3-(homoveratroylamino)thiourea Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NNC(=S)NCC2=CC=CC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NNC(=S)NCC2=CC=CC=C2)OC

InChI

InChI=1S/C18H21N3O3S/c1-23-15-9-8-14(10-16(15)24-2)11-17(22)20-21-18(25)19-12-13-6-4-3-5-7-13/h3-10H,11-12H2,1-2H3,(H,20,22)(H2,19,21,25)