2-(1-azanyl-3-methylsulfanyl-propyl)-N-(1,3-benzodioxol-5-yl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-(1,3-benzodioxol-5-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-(1,3-benzodioxol-5-yl)thiazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-(1,3-benzodioxol-5-yl)-4-thiazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-(1,3-benzodioxol-5-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-(1,3-benzodioxol-5-yl)thiazole-4-carboxamide Formula: C15H17N3O3S2 MolecularWeight: 351.44378

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=CS1)C(=O)NC2=CC3=C(C=C2)OCO3)N

Isomeric SMILES

CSCCC(C1=NC(=CS1)C(=O)NC2=CC3=C(C=C2)OCO3)N

InChI

InChI=1S/C15H17N3O3S2/c1-22-5-4-10(16)15-18-11(7-23-15)14(19)17-9-2-3-12-13(6-9)21-8-20-12/h2-3,6-7,10H,4-5,8,16H2,1H3,(H,17,19)