N-[2-(4-methoxyphenyl)ethyl]azocane-1-carbothioamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]azocane-1-carbothioamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]azocane-1-carbothioamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-1-azocanecarbothioamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]azocane-1-carbothioamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]azocane-1-carbothioamide Formula: C17H26N2OS MolecularWeight: 306.46614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=S)N2CCCCCCC2

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=S)N2CCCCCCC2

InChI

InChI=1S/C17H26N2OS/c1-20-16-9-7-15(8-10-16)11-12-18-17(21)19-13-5-3-2-4-6-14-19/h7-10H,2-6,11-14H2,1H3,(H,18,21)