N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[5-[(4-ethylphenyl)methyl]thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[5-[(4-ethylphenyl)methyl]-2-thiazolyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[5-(4-ethylbenzyl)thiazol-2-yl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H20N2O3S/c1-2-14-3-5-15(6-4-14)11-17-13-22-21(27-17)23-20(24)16-7-8-18-19(12-16)26-10-9-25-18/h3-8,12-13H,2,9-11H2,1H3,(H,22,23,24)