methyl (Z)-13-(pentylcarbamothioylamino)tridec-8-enoate

Systemtic Name: methyl (Z)-13-(pentylcarbamothioylamino)tridec-8-enoate Openeye Name: methyl (Z)-13-(pentylcarbamothioylamino)tridec-8-enoate CAS Name: (Z)-13-[[(pentylamino)-sulfanylidenemethyl]amino]-8-tridecenoic acid methyl ester IUPAC Name: methyl (Z)-13-(pentylcarbamothioylamino)tridec-8-enoate Traditional Name: (Z)-13-(amylthiocarbamoylamino)tridec-8-enoic acid methyl ester Formula: C20H38N2O2S MolecularWeight: 370.59292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NCCCCC=CCCCCCCC(=O)OC

Isomeric SMILES

CCCCCNC(=S)NCCCC/C=C\CCCCCCC(=O)OC

InChI

InChI=1S/C20H38N2O2S/c1-3-4-14-17-21-20(25)22-18-15-12-10-8-6-5-7-9-11-13-16-19(23)24-2/h6,8H,3-5,7,9-18H2,1-2H3,(H2,21,22,25)/b8-6-