N-[(E)-[2-(4-tert-butylphenyl)-5,7-dimethyl-chromen-4-ylidene]amino]-1,3-benzothiazol-2-amine

Systemtic Name: N-[(E)-[2-(4-tert-butylphenyl)-5,7-dimethyl-chromen-4-ylidene]amino]-1,3-benzothiazol-2-amine Openeye Name: N-[(E)-[2-(4-tert-butylphenyl)-5,7-dimethyl-chromen-4-ylidene]amino]-1,3-benzothiazol-2-amine CAS Name: N-[(E)-[2-(4-tert-butylphenyl)-5,7-dimethyl-1-benzopyran-4-ylidene]amino]-1,3-benzothiazol-2-amine IUPAC Name: N-[(E)-[2-(4-tert-butylphenyl)-5,7-dimethylchromen-4-ylidene]amino]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[(E)-[2-(4-tert-butylphenyl)-5,7-dimethyl-chromen-4-ylidene]amino]amine Formula: C28H27N3OS MolecularWeight: 453.59848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)OC(=CC2=NNC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C\2C(=C1)OC(=C/C2=N\NC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)C(C)(C)C)C

InChI

InChI=1S/C28H27N3OS/c1-17-14-18(2)26-22(30-31-27-29-21-8-6-7-9-25(21)33-27)16-23(32-24(26)15-17)19-10-12-20(13-11-19)28(3,4)5/h6-16H,1-5H3,(H,29,31)/b30-22+