N-(1,3-benzothiazol-2-ylmethyl)-1-(5-bromanyl-2-methoxy-phenyl)methanamine

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(5-bromanyl-2-methoxy-phenyl)methanamine Openeye Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(5-bromo-2-methoxy-phenyl)methanamine CAS Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(5-bromo-2-methoxyphenyl)methanamine IUPAC Name: N-(1,3-benzothiazol-2-ylmethyl)-1-(5-bromo-2-methoxyphenyl)methanamine Traditional Name: 1,3-benzothiazol-2-ylmethyl-(5-bromo-2-methoxy-benzyl)amine Formula: C16H15BrN2OS MolecularWeight: 363.2721

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CNCC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CNCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H15BrN2OS/c1-20-14-7-6-12(17)8-11(14)9-18-10-16-19-13-4-2-3-5-15(13)21-16/h2-8,18H,9-10H2,1H3