N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methyl-2-(phenylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-benzyl-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methyl-thiazole-5-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methyl-2-(phenylmethyl)-5-thiazolecarboxamide IUPAC Name: 2-benzyl-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-benzyl-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-methyl-thiazole-5-carboxamide Formula: C20H17BrN2O3S MolecularWeight: 445.32958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C20H17BrN2O3S/c1-12-19(27-18(22-12)9-13-5-3-2-4-6-13)20(24)23-15-11-17-16(10-14(15)21)25-7-8-26-17/h2-6,10-11H,7-9H2,1H3,(H,23,24)