5-bromanyl-N-[(3,4-dichlorophenyl)methyl]-N-(1-isothiocyanatopropan-2-yl)pyridin-2-amine

Systemtic Name: 5-bromanyl-N-[(3,4-dichlorophenyl)methyl]-N-(1-isothiocyanatopropan-2-yl)pyridin-2-amine Openeye Name: 5-bromo-N-[(3,4-dichlorophenyl)methyl]-N-(2-isothiocyanato-1-methyl-ethyl)pyridin-2-amine CAS Name: 5-bromo-N-[(3,4-dichlorophenyl)methyl]-N-(1-isothiocyanatopropan-2-yl)-2-pyridinamine IUPAC Name: 5-bromo-N-[(3,4-dichlorophenyl)methyl]-N-(1-isothiocyanatopropan-2-yl)pyridin-2-amine Traditional Name: (5-bromo-2-pyridyl)-(3,4-dichlorobenzyl)-(2-isothiocyanato-1-methyl-ethyl)amine Formula: C16H14BrCl2N3S MolecularWeight: 431.17746

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN=C=S)N(CC1=CC(=C(C=C1)Cl)Cl)C2=NC=C(C=C2)Br

Isomeric SMILES

CC(CN=C=S)N(CC1=CC(=C(C=C1)Cl)Cl)C2=NC=C(C=C2)Br

InChI

InChI=1S/C16H14BrCl2N3S/c1-11(7-20-10-23)22(16-5-3-13(17)8-21-16)9-12-2-4-14(18)15(19)6-12/h2-6,8,11H,7,9H2,1H3