3-(1,3-benzothiazol-2-ylmethyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-urea

Systemtic Name: 3-(1,3-benzothiazol-2-ylmethyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-urea Openeye Name: 3-(1,3-benzothiazol-2-ylmethyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-urea CAS Name: 3-(1,3-benzothiazol-2-ylmethyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylurea IUPAC Name: 3-(1,3-benzothiazol-2-ylmethyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylurea Traditional Name: 3-(1,3-benzothiazol-2-ylmethyl)-1-homoveratryl-1-methyl-urea Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=O)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H23N3O3S/c1-23(11-10-14-8-9-16(25-2)17(12-14)26-3)20(24)21-13-19-22-15-6-4-5-7-18(15)27-19/h4-9,12H,10-11,13H2,1-3H3,(H,21,24)