N-(1,3-benzodioxol-5-ylmethyl)-2-(4-prop-2-enoxyphenyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-prop-2-enoxyphenyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(4-allyloxyphenyl)-N-(1,3-benzodioxol-5-ylmethyl)thiazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-prop-2-enoxyphenyl)-4-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(4-prop-2-enoxyphenyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(4-allyloxyphenyl)-N-piperonyl-thiazole-4-carboxamide Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C=CCOC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H18N2O4S/c1-2-9-25-16-6-4-15(5-7-16)21-23-17(12-28-21)20(24)22-11-14-3-8-18-19(10-14)27-13-26-18/h2-8,10,12H,1,9,11,13H2,(H,22,24)