3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(5-methylthiophen-2-yl)methyl]-N-phenethyl-propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(5-methylthiophen-2-yl)methyl]-N-phenethyl-propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(5-methyl-2-thiophenyl)methyl]-N-phenethylpropanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(5-methylthiophen-2-yl)methyl]-N-phenethylpropanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[(5-methyl-2-thienyl)methyl]-N-phenethyl-propionamide Formula: C25H27NO5S2 MolecularWeight: 485.61558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)C(=O)CCS(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C25H27NO5S2/c1-19-7-8-21(32-19)18-26(13-11-20-5-3-2-4-6-20)25(27)12-16-33(28,29)22-9-10-23-24(17-22)31-15-14-30-23/h2-10,17H,11-16,18H2,1H3