3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methylpropanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methylpropanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(1,3-benzothiazol-2-ylmethyl)-N-methyl-propionamide Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)C(=O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)C(=O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H18N2O3S/c1-21(11-18-20-14-4-2-3-5-17(14)25-18)19(22)9-7-13-6-8-15-16(10-13)24-12-23-15/h2-6,8,10H,7,9,11-12H2,1H3