N-[(E)-(4-bromanyl-3-methoxy-4-phenyl-butan-2-ylidene)amino]-3-methyl-1,3-benzothiazol-2-imine

Systemtic Name: N-[(E)-(4-bromanyl-3-methoxy-4-phenyl-butan-2-ylidene)amino]-3-methyl-1,3-benzothiazol-2-imine Openeye Name: N-[(E)-(3-bromo-2-methoxy-1-methyl-3-phenyl-propylidene)amino]-3-methyl-1,3-benzothiazol-2-imine CAS Name: N-[(E)-(4-bromo-3-methoxy-4-phenylbutan-2-ylidene)amino]-3-methyl-1,3-benzothiazol-2-imine IUPAC Name: N-[(E)-(4-bromo-3-methoxy-4-phenylbutan-2-ylidene)amino]-3-methyl-1,3-benzothiazol-2-imine Traditional Name: (E)-(3-bromo-2-methoxy-1-methyl-3-phenyl-propylidene)-[(E)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]amine Formula: C19H20BrN3OS MolecularWeight: 418.3506

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN=C1N(C2=CC=CC=C2S1)C)C(C(C3=CC=CC=C3)Br)OC

Isomeric SMILES

C/C(=N\N=C\1/N(C2=CC=CC=C2S1)C)/C(C(C3=CC=CC=C3)Br)OC

InChI

InChI=1S/C19H20BrN3OS/c1-13(18(24-3)17(20)14-9-5-4-6-10-14)21-22-19-23(2)15-11-7-8-12-16(15)25-19/h4-12,17-18H,1-3H3/b21-13+,22-19+