3-(heptan-2-ylcarbamoylamino)-5-thiophen-2-yl-thiophene-2-carboxylic acid

Systemtic Name: 3-(heptan-2-ylcarbamoylamino)-5-thiophen-2-yl-thiophene-2-carboxylic acid Openeye Name: 3-(1-methylhexylcarbamoylamino)-5-(2-thienyl)thiophene-2-carboxylic acid CAS Name: 3-[[(heptan-2-ylamino)-oxomethyl]amino]-5-thiophen-2-yl-2-thiophenecarboxylic acid IUPAC Name: 3-(heptan-2-ylcarbamoylamino)-5-thiophen-2-ylthiophene-2-carboxylic acid Traditional Name: 3-(1-methylhexylcarbamoylamino)-5-(2-thienyl)-2-thenoic acid Formula: C17H22N2O3S2 MolecularWeight: 366.49818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)NC1=C(SC(=C1)C2=CC=CS2)C(=O)O

Isomeric SMILES

CCCCCC(C)NC(=O)NC1=C(SC(=C1)C2=CC=CS2)C(=O)O

InChI

InChI=1S/C17H22N2O3S2/c1-3-4-5-7-11(2)18-17(22)19-12-10-14(13-8-6-9-23-13)24-15(12)16(20)21/h6,8-11H,3-5,7H2,1-2H3,(H,20,21)(H2,18,19,22)