N-(3,4-dimethoxyphenyl)-6-imidazol-1-yl-hexanethioamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-6-imidazol-1-yl-hexanethioamide Openeye Name: N-(3,4-dimethoxyphenyl)-6-imidazol-1-yl-hexanethioamide CAS Name: N-(3,4-dimethoxyphenyl)-6-(1-imidazolyl)hexanethioamide IUPAC Name: N-(3,4-dimethoxyphenyl)-6-imidazol-1-ylhexanethioamide Traditional Name: N-(3,4-dimethoxyphenyl)-6-imidazol-1-yl-hexanethioamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)CCCCCN2C=CN=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)CCCCCN2C=CN=C2)OC

InChI

InChI=1S/C17H23N3O2S/c1-21-15-8-7-14(12-16(15)22-2)19-17(23)6-4-3-5-10-20-11-9-18-13-20/h7-9,11-13H,3-6,10H2,1-2H3,(H,19,23)