1-(3,4-dihydro-2H-thiochromen-4-yl)-3-[(3,4-dimethoxyphenyl)methyl]urea

Systemtic Name: 1-(3,4-dihydro-2H-thiochromen-4-yl)-3-[(3,4-dimethoxyphenyl)methyl]urea Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-3-thiochroman-4-yl-urea CAS Name: 1-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-3-[(3,4-dimethoxyphenyl)methyl]urea IUPAC Name: 1-(3,4-dihydro-2H-thiochromen-4-yl)-3-[(3,4-dimethoxyphenyl)methyl]urea Traditional Name: 1-thiochroman-4-yl-3-veratryl-urea Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)NC2CCSC3=CC=CC=C23)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)NC2CCSC3=CC=CC=C23)OC

InChI

InChI=1S/C19H22N2O3S/c1-23-16-8-7-13(11-17(16)24-2)12-20-19(22)21-15-9-10-25-18-6-4-3-5-14(15)18/h3-8,11,15H,9-10,12H2,1-2H3,(H2,20,21,22)