2-(1,3-benzodioxol-5-ylcarbonylamino)-N-(thiophen-2-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1,3-benzodioxol-5-ylcarbonylamino)-N-(thiophen-2-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(1,3-benzodioxole-5-carbonylamino)-N-(2-thienylmethyl)thiazole-4-carboxamide CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-N-(thiophen-2-ylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-(1,3-benzodioxole-5-carbonylamino)-N-(thiophen-2-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(piperonyloylamino)-N-(2-thenyl)thiazole-4-carboxamide Formula: C17H13N3O4S2 MolecularWeight: 387.43282

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NC(=CS3)C(=O)NCC4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC3=NC(=CS3)C(=O)NCC4=CC=CS4

InChI

InChI=1S/C17H13N3O4S2/c21-15(10-3-4-13-14(6-10)24-9-23-13)20-17-19-12(8-26-17)16(22)18-7-11-2-1-5-25-11/h1-6,8H,7,9H2,(H,18,22)(H,19,20,21)