N,N-dihexyl-5-isothiocyanato-pyridin-2-amine

Systemtic Name: N,N-dihexyl-5-isothiocyanato-pyridin-2-amine Openeye Name: N,N-dihexyl-5-isothiocyanato-pyridin-2-amine CAS Name: N,N-dihexyl-5-isothiocyanato-2-pyridinamine IUPAC Name: N,N-dihexyl-5-isothiocyanatopyridin-2-amine Traditional Name: dihexyl-(5-isothiocyanato-2-pyridyl)amine Formula: C18H29N3S MolecularWeight: 319.50796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C1=NC=C(C=C1)N=C=S

Isomeric SMILES

CCCCCCN(CCCCCC)C1=NC=C(C=C1)N=C=S

InChI

InChI=1S/C18H29N3S/c1-3-5-7-9-13-21(14-10-8-6-4-2)18-12-11-17(15-19-18)20-16-22/h11-12,15H,3-10,13-14H2,1-2H3