1-(1,3-benzothiazol-2-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[2-(3,4-dimethoxyphenyl)ethyl]thiourea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-homoveratryl-thiourea Formula: C18H19N3O2S2 MolecularWeight: 373.49236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NC2=NC3=CC=CC=C3S2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NC2=NC3=CC=CC=C3S2)OC

InChI

InChI=1S/C18H19N3O2S2/c1-22-14-8-7-12(11-15(14)23-2)9-10-19-17(24)21-18-20-13-5-3-4-6-16(13)25-18/h3-8,11H,9-10H2,1-2H3,(H2,19,20,21,24)