5-[[3-(2-azanylethyl)-1H-indol-5-yl]-thiophen-3-yl-methyl]imidazolidine-2,4-dione; (E)-but-2-enedioic acid

Systemtic Name: 5-[[3-(2-azanylethyl)-1H-indol-5-yl]-thiophen-3-yl-methyl]imidazolidine-2,4-dione; (E)-but-2-enedioic acid Openeye Name: 5-[[3-(2-aminoethyl)-1H-indol-5-yl]-(3-thienyl)methyl]imidazolidine-2,4-dione; fumaric acid CAS Name: 5-[[3-(2-aminoethyl)-1H-indol-5-yl]-(3-thiophenyl)methyl]imidazolidine-2,4-dione; (E)-2-butenedioic acid IUPAC Name: 5-[[3-(2-aminoethyl)-1H-indol-5-yl]-thiophen-3-ylmethyl]imidazolidine-2,4-dione; (E)-but-2-enedioic acid Traditional Name: 5-[[3-(2-aminoethyl)-1H-indol-5-yl]-(3-thienyl)methyl]hydantoin; fumaric acid Formula: C22H22N4O6S MolecularWeight: 470.49828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(C3C(=O)NC(=O)N3)C4=CSC=C4)C(=CN2)CCN.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1C(C3C(=O)NC(=O)N3)C4=CSC=C4)C(=CN2)CCN.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C18H18N4O2S.C4H4O4/c19-5-3-11-8-20-14-2-1-10(7-13(11)14)15(12-4-6-25-9-12)16-17(23)22-18(24)21-16;5-3(6)1-2-4(7)8/h1-2,4,6-9,15-16,20H,3,5,19H2,(H2,21,22,23,24);1-2H,(H,5,6)(H,7,8)/b;2-1+