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

Systemtic Name: N-[(E)-[2-(4-tert-butylphenyl)-7-methyl-chromen-4-ylidene]amino]-1,3-benzothiazol-2-amine Openeye Name: N-[(E)-[2-(4-tert-butylphenyl)-7-methyl-chromen-4-ylidene]amino]-1,3-benzothiazol-2-amine CAS Name: N-[(E)-[2-(4-tert-butylphenyl)-7-methyl-1-benzopyran-4-ylidene]amino]-1,3-benzothiazol-2-amine IUPAC Name: N-[(E)-[2-(4-tert-butylphenyl)-7-methylchromen-4-ylidene]amino]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[(E)-[2-(4-tert-butylphenyl)-7-methyl-chromen-4-ylidene]amino]amine Formula: C27H25N3OS MolecularWeight: 439.5719

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NNC3=NC4=CC=CC=C4S3)C=C(O2)C5=CC=C(C=C5)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)/C(=N/NC3=NC4=CC=CC=C4S3)/C=C(O2)C5=CC=C(C=C5)C(C)(C)C

InChI

InChI=1S/C27H25N3OS/c1-17-9-14-20-22(29-30-26-28-21-7-5-6-8-25(21)32-26)16-23(31-24(20)15-17)18-10-12-19(13-11-18)27(2,3)4/h5-16H,1-4H3,(H,28,30)/b29-22+