1-(4-chlorophenyl)-3-(3,3-dimethoxypropanoylamino)thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-(3,3-dimethoxypropanoylamino)thiourea Openeye Name: 1-(4-chlorophenyl)-3-(3,3-dimethoxypropanoylamino)thiourea CAS Name: 1-(4-chlorophenyl)-3-[(3,3-dimethoxy-1-oxopropyl)amino]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-(3,3-dimethoxypropanoylamino)thiourea Traditional Name: 1-(4-chlorophenyl)-3-(3,3-dimethoxypropanoylamino)thiourea Formula: C12H16ClN3O3S MolecularWeight: 317.79174

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC(=O)NNC(=S)NC1=CC=C(C=C1)Cl)OC

Isomeric SMILES

COC(CC(=O)NNC(=S)NC1=CC=C(C=C1)Cl)OC

InChI

InChI=1S/C12H16ClN3O3S/c1-18-11(19-2)7-10(17)15-16-12(20)14-9-5-3-8(13)4-6-9/h3-6,11H,7H2,1-2H3,(H,15,17)(H2,14,16,20)