5-(1,3-benzodioxol-5-yl)-1-(2-methoxyethanoyl)-4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-1-(2-methoxyethanoyl)-4-(2-methylphenyl)carbonyl-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-1-(2-methoxyacetyl)-4-(2-methylbenzoyl)-3-(3-methyl-2-thienyl)pyrrolidine-2-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-1-(2-methoxy-1-oxoethyl)-4-[(2-methylphenyl)-oxomethyl]-3-(3-methyl-2-thiophenyl)-2-pyrrolidinecarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-1-(2-methoxyacetyl)-4-(2-methylbenzoyl)-3-(3-methylthiophen-2-yl)pyrrolidine-2-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-1-(2-methoxyacetyl)-3-(3-methyl-2-thienyl)-4-o-toluoyl-pyrrolidine-2-carboxamide Formula: C28H28N2O6S MolecularWeight: 520.59672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(N(C2C(=O)N)C(=O)COC)C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CC=C5C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(N(C2C(=O)N)C(=O)COC)C3=CC4=C(C=C3)OCO4)C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C28H28N2O6S/c1-15-6-4-5-7-18(15)26(32)22-23(27-16(2)10-11-37-27)25(28(29)33)30(21(31)13-34-3)24(22)17-8-9-19-20(12-17)36-14-35-19/h4-12,22-25H,13-14H2,1-3H3,(H2,29,33)