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

Systemtic Name: 2-(1-azanylpentyl)-N-(1,3-benzodioxol-5-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-aminopentyl)-N-(1,3-benzodioxol-5-ylmethyl)thiazole-4-carboxamide CAS Name: 2-(1-aminopentyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-(1-aminopentyl)-N-(1,3-benzodioxol-5-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-(1-aminopentyl)-N-piperonyl-thiazole-4-carboxamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O3S/c1-2-3-4-12(18)17-20-13(9-24-17)16(21)19-8-11-5-6-14-15(7-11)23-10-22-14/h5-7,9,12H,2-4,8,10,18H2,1H3,(H,19,21)