(E)-N'-aminocarbonyl-N'-[3-aminocarbonyl-5-(phenylmethyl)thiophen-2-yl]but-2-enediamide

Systemtic Name: (E)-N'-aminocarbonyl-N'-[3-aminocarbonyl-5-(phenylmethyl)thiophen-2-yl]but-2-enediamide Openeye Name: (E)-N'-(5-benzyl-3-carbamoyl-2-thienyl)-N'-carbamoyl-but-2-enediamide CAS Name: (E)-N'-carbamoyl-N'-[3-carbamoyl-5-(phenylmethyl)-2-thiophenyl]-2-butenediamide IUPAC Name: (E)-N'-(5-benzyl-3-carbamoylthiophen-2-yl)-N'-carbamoylbut-2-enediamide Traditional Name: (E)-N'-(5-benzyl-3-carbamoyl-2-thienyl)-N'-carbamoyl-but-2-enediamide Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC(=C(S2)N(C(=O)C=CC(=O)N)C(=O)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC(=C(S2)N(C(=O)/C=C/C(=O)N)C(=O)N)C(=O)N

InChI

InChI=1S/C17H16N4O4S/c18-13(22)6-7-14(23)21(17(20)25)16-12(15(19)24)9-11(26-16)8-10-4-2-1-3-5-10/h1-7,9H,8H2,(H2,18,22)(H2,19,24)(H2,20,25)/b7-6+