N-[(E)-(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-1,3-benzothiazol-2-amine

Systemtic Name: N-[(E)-(5-bromanyl-2-prop-2-ynoxy-phenyl)methylideneamino]-1,3-benzothiazol-2-amine Openeye Name: N-[(E)-(5-bromo-2-prop-2-ynoxy-phenyl)methyleneamino]-1,3-benzothiazol-2-amine CAS Name: N-[(E)-(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-1,3-benzothiazol-2-amine IUPAC Name: N-[(E)-(5-bromo-2-prop-2-ynoxyphenyl)methylideneamino]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[(E)-(5-bromo-2-propargyloxy-benzylidene)amino]amine Formula: C17H12BrN3OS MolecularWeight: 386.26568

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=C(C=C(C=C1)Br)C=NNC2=NC3=CC=CC=C3S2

Isomeric SMILES

C#CCOC1=C(C=C(C=C1)Br)/C=N/NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H12BrN3OS/c1-2-9-22-15-8-7-13(18)10-12(15)11-19-21-17-20-14-5-3-4-6-16(14)23-17/h1,3-8,10-11H,9H2,(H,20,21)/b19-11+