N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(4-sec-butylphenyl)thiazol-2-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-(4-butan-2-ylphenyl)-2-thiazolyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(4-butan-2-ylphenyl)-1,3-thiazol-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(4-sec-butylphenyl)thiazol-2-yl]-piperonylamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H20N2O3S/c1-3-13(2)14-4-6-15(7-5-14)17-11-27-21(22-17)23-20(24)16-8-9-18-19(10-16)26-12-25-18/h4-11,13H,3,12H2,1-2H3,(H,22,23,24)