N-butyl-4-(2,4-dimethoxyphenyl)-3-[(E)-hexan-2-ylideneamino]-1,3-thiazol-2-imine

Systemtic Name: N-butyl-4-(2,4-dimethoxyphenyl)-3-[(E)-hexan-2-ylideneamino]-1,3-thiazol-2-imine Openeye Name: N-butyl-4-(2,4-dimethoxyphenyl)-3-[(E)-1-methylpentylideneamino]thiazol-2-imine CAS Name: N-butyl-4-(2,4-dimethoxyphenyl)-3-[(E)-hexan-2-ylideneamino]-2-thiazolimine IUPAC Name: N-butyl-4-(2,4-dimethoxyphenyl)-3-[(E)-hexan-2-ylideneamino]-1,3-thiazol-2-imine Traditional Name: butyl-[4-(2,4-dimethoxyphenyl)-3-[(E)-1-methylpentylideneamino]-4-thiazolin-2-ylidene]amine Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NN1C(=CSC1=NCCCC)C2=C(C=C(C=C2)OC)OC)C

Isomeric SMILES

CCCC/C(=N/N1C(=CSC1=NCCCC)C2=C(C=C(C=C2)OC)OC)/C

InChI

InChI=1S/C21H31N3O2S/c1-6-8-10-16(3)23-24-19(15-27-21(24)22-13-9-7-2)18-12-11-17(25-4)14-20(18)26-5/h11-12,14-15H,6-10,13H2,1-5H3/b22-21?,23-16+