dipentyl 2-[dodecyl(sulfanyl)carbamothioyl]butanedioate

Systemtic Name: dipentyl 2-[dodecyl(sulfanyl)carbamothioyl]butanedioate Openeye Name: dipentyl 2-[dodecyl(sulfanyl)carbamothioyl]butanedioate CAS Name: 2-[[dodecyl(mercapto)amino]-sulfanylidenemethyl]butanedioic acid dipentyl ester IUPAC Name: dipentyl 2-[dodecyl(sulfanyl)carbamothioyl]butanedioate Traditional Name: 2-[lauryl(mercapto)thiocarbamoyl]succinic acid diamyl ester Formula: C27H51NO4S2 MolecularWeight: 517.82814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(C(=S)C(CC(=O)OCCCCC)C(=O)OCCCCC)S

Isomeric SMILES

CCCCCCCCCCCCN(C(=S)C(CC(=O)OCCCCC)C(=O)OCCCCC)S

InChI

InChI=1S/C27H51NO4S2/c1-4-7-10-11-12-13-14-15-16-17-20-28(34)26(33)24(27(30)32-22-19-9-6-3)23-25(29)31-21-18-8-5-2/h24,34H,4-23H2,1-3H3