4-cyano-N-ethyl-5-(2-ethylbutanoylamino)-3-methyl-N-(phenylmethyl)thiophene-2-carboxamide

Systemtic Name: 4-cyano-N-ethyl-5-(2-ethylbutanoylamino)-3-methyl-N-(phenylmethyl)thiophene-2-carboxamide Openeye Name: N-benzyl-4-cyano-N-ethyl-5-(2-ethylbutanoylamino)-3-methyl-thiophene-2-carboxamide CAS Name: 4-cyano-N-ethyl-5-[(2-ethyl-1-oxobutyl)amino]-3-methyl-N-(phenylmethyl)-2-thiophenecarboxamide IUPAC Name: N-benzyl-4-cyano-N-ethyl-5-(2-ethylbutanoylamino)-3-methylthiophene-2-carboxamide Traditional Name: N-benzyl-4-cyano-N-ethyl-5-(2-ethylbutanoylamino)-3-methyl-thiophene-2-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)NC1=C(C(=C(S1)C(=O)N(CC)CC2=CC=CC=C2)C)C#N

Isomeric SMILES

CCC(CC)C(=O)NC1=C(C(=C(S1)C(=O)N(CC)CC2=CC=CC=C2)C)C#N

InChI

InChI=1S/C22H27N3O2S/c1-5-17(6-2)20(26)24-21-18(13-23)15(4)19(28-21)22(27)25(7-3)14-16-11-9-8-10-12-16/h8-12,17H,5-7,14H2,1-4H3,(H,24,26)