5-(1,3-benzodioxol-5-yl)-3-(4-tert-butylphenyl)-N1-ethyl-4-thiophen-2-ylcarbonyl-pyrrolidine-1,2-dicarboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-3-(4-tert-butylphenyl)-N1-ethyl-4-thiophen-2-ylcarbonyl-pyrrolidine-1,2-dicarboxamide Openeye Name: 5-(1,3-benzodioxol-5-yl)-3-(4-tert-butylphenyl)-N1-ethyl-4-(thiophene-2-carbonyl)pyrrolidine-1,2-dicarboxamide CAS Name: 5-(1,3-benzodioxol-5-yl)-3-(4-tert-butylphenyl)-N1-ethyl-4-[oxo(thiophen-2-yl)methyl]pyrrolidine-1,2-dicarboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yl)-3-(4-tert-butylphenyl)-1-N-ethyl-4-(thiophene-2-carbonyl)pyrrolidine-1,2-dicarboxamide Traditional Name: 5-(1,3-benzodioxol-5-yl)-3-(4-tert-butylphenyl)-N-ethyl-4-(2-thenoyl)pyrrolidine-1,2-dicarboxamide Formula: C30H33N3O5S MolecularWeight: 547.66512

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(C(C(C1C(=O)N)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3=CC=CS3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCNC(=O)N1C(C(C(C1C(=O)N)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3=CC=CS3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C30H33N3O5S/c1-5-32-29(36)33-25(18-10-13-20-21(15-18)38-16-37-20)24(27(34)22-7-6-14-39-22)23(26(33)28(31)35)17-8-11-19(12-9-17)30(2,3)4/h6-15,23-26H,5,16H2,1-4H3,(H2,31,35)(H,32,36)