N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylphenyl)amino]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(3,4-dimethylphenyl)amino]-1,3-thiazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylanilino)thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylanilino)-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3,4-dimethylanilino)-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,4-dimethylanilino)-N-piperonyl-thiazole-4-carboxamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C20H19N3O3S/c1-12-3-5-15(7-13(12)2)22-20-23-16(10-27-20)19(24)21-9-14-4-6-17-18(8-14)26-11-25-17/h3-8,10H,9,11H2,1-2H3,(H,21,24)(H,22,23)