3,5-bis(azanyl)-2-dodecyl-benzenecarbothioic S-acid

Systemtic Name: 3,5-bis(azanyl)-2-dodecyl-benzenecarbothioic S-acid Openeye Name: 3,5-diamino-2-dodecyl-benzenecarbothioic S-acid CAS Name: 3,5-diamino-2-dodecylbenzenecarbothioic S-acid IUPAC Name: 3,5-diamino-2-dodecylbenzenecarbothioic S-acid Traditional Name: 3,5-diamino-2-lauryl-thiobenzoic acid Formula: C19H32N2OS MolecularWeight: 336.53518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C=C(C=C1C(=O)S)N)N

Isomeric SMILES

CCCCCCCCCCCCC1=C(C=C(C=C1C(=O)S)N)N

InChI

InChI=1S/C19H32N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(19(22)23)13-15(20)14-18(16)21/h13-14H,2-12,20-21H2,1H3,(H,22,23)