2-(1-azanyl-3-methyl-butyl)-N-(1,3-benzodioxol-5-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-3-methyl-butyl)-N-(1,3-benzodioxol-5-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-amino-3-methyl-butyl)-N-(1,3-benzodioxol-5-ylmethyl)thiazole-4-carboxamide CAS Name: 2-(1-amino-3-methylbutyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-(1-amino-3-methylbutyl)-N-(1,3-benzodioxol-5-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(1-amino-3-methyl-butyl)-N-piperonyl-thiazole-4-carboxamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC(=CS1)C(=O)NCC2=CC3=C(C=C2)OCO3)N

Isomeric SMILES

CC(C)CC(C1=NC(=CS1)C(=O)NCC2=CC3=C(C=C2)OCO3)N

InChI

InChI=1S/C17H21N3O3S/c1-10(2)5-12(18)17-20-13(8-24-17)16(21)19-7-11-3-4-14-15(6-11)23-9-22-14/h3-4,6,8,10,12H,5,7,9,18H2,1-2H3,(H,19,21)