sodium; cyclohexyl(ethyl)azanium; N-(2-cyclohexylethyl)carbamodithioate

Systemtic Name: sodium; cyclohexyl(ethyl)azanium; N-(2-cyclohexylethyl)carbamodithioate Openeye Name: sodium; cyclohexyl(ethyl)ammonium; N-(2-cyclohexylethyl)carbamodithioate CAS Name: sodium; cyclohexyl(ethyl)ammonium; N-(2-cyclohexylethyl)carbamodithioate IUPAC Name: sodium; cyclohexyl(ethyl)azanium; N-(2-cyclohexylethyl)carbamodithioate Traditional Name: sodium; cyclohexyl(ethyl)ammonium; N-(2-cyclohexylethyl)carbamodithioate Formula: C26H50N3NaS4 MolecularWeight: 555.94507

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]C1CCCCC1.C1CCC(CC1)CCNC(=S)[S-].C1CCC(CC1)CCNC(=S)[S-].[Na+]

Isomeric SMILES

CC[NH2+]C1CCCCC1.C1CCC(CC1)CCNC(=S)[S-].C1CCC(CC1)CCNC(=S)[S-].[Na+]

InChI

InChI=1S/2C9H17NS2.C8H17N.Na/c2*11-9(12)10-7-6-8-4-2-1-3-5-8;1-2-9-8-6-4-3-5-7-8;/h2*8H,1-7H2,(H2,10,11,12);8-9H,2-7H2,1H3;/q;;;+1/p-1