5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2,4,6-trimethylphenyl)-1,3-thiazol-2-amine

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2,4,6-trimethylphenyl)-1,3-thiazol-2-amine Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2,4,6-trimethylphenyl)thiazol-2-amine CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2,4,6-trimethylphenyl)-2-thiazolamine IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2,4,6-trimethylphenyl)-1,3-thiazol-2-amine Traditional Name: [5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]-mesityl-amine Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC2=NC=C(S2)C3=CC4=C(C=C3)OCCCO4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC2=NC=C(S2)C3=CC4=C(C=C3)OCCCO4)C

InChI

InChI=1S/C21H22N2O2S/c1-13-9-14(2)20(15(3)10-13)23-21-22-12-19(26-21)16-5-6-17-18(11-16)25-8-4-7-24-17/h5-6,9-12H,4,7-8H2,1-3H3,(H,22,23)