sodium 2-[[(E)-octadec-9-enyl]amino]-5-sulfanyl-1,2-dihydro-1,3,5-triazine-6-thione

Systemtic Name: sodium 2-[[(E)-octadec-9-enyl]amino]-5-sulfanyl-1,2-dihydro-1,3,5-triazine-6-thione Openeye Name: sodium 2-[[(E)-octadec-9-enyl]amino]-5-sulfanyl-1,2-dihydro-1,3,5-triazine-6-thione CAS Name: sodium 5-mercapto-2-[[(E)-octadec-9-enyl]amino]-1,2-dihydro-1,3,5-triazine-6-thione IUPAC Name: sodium 2-[[(E)-octadec-9-enyl]amino]-5-sulfanyl-1,2-dihydro-1,3,5-triazine-6-thione Traditional Name: sodium 5-mercapto-2-[[(E)-octadec-9-enyl]amino]-1,2-dihydro-s-triazine-6-thione Formula: C21H40N4NaS2+ MolecularWeight: 435.68887

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCNC1NC(=S)N(C=N1)S.[Na+]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCNC1NC(=S)N(C=N1)S.[Na+]

InChI

InChI=1S/C21H40N4S2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-20-23-19-25(27)21(26)24-20;/h9-10,19-20,22,27H,2-8,11-18H2,1H3,(H,24,26);/q;+1/b10-9+;