2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)ethanamide

Systemtic Name: 2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)ethanamide Openeye Name: 2-[2-(m-tolyl)thiazol-4-yl]-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide CAS Name: 2-[2-(3-methylphenyl)-4-thiazolyl]-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide IUPAC Name: 2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide Traditional Name: 2-[2-(m-tolyl)thiazol-4-yl]-N-(6-nitro-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCCO4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCCO4

InChI

InChI=1S/C20H17N3O5S/c1-12-3-2-4-13(7-12)20-21-14(11-29-20)8-19(24)22-15-9-17-18(28-6-5-27-17)10-16(15)23(25)26/h2-4,7,9-11H,5-6,8H2,1H3,(H,22,24)