2-acetamido-N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-methyl-butanamide

Systemtic Name: 2-acetamido-N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-methyl-butanamide Openeye Name: 2-acetamido-N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-methyl-butanamide CAS Name: 2-acetamido-N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-3-methylbutanamide IUPAC Name: 2-acetamido-N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-methylbutanamide Traditional Name: 2-acetamido-N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-methyl-butyramide Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=NC(=CS1)C2=CC3=C(C=C2)OCO3)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)NC1=NC(=CS1)C2=CC3=C(C=C2)OCO3)NC(=O)C

InChI

InChI=1S/C17H19N3O4S/c1-9(2)15(18-10(3)21)16(22)20-17-19-12(7-25-17)11-4-5-13-14(6-11)24-8-23-13/h4-7,9,15H,8H2,1-3H3,(H,18,21)(H,19,20,22)