N,N-dicyclohexyl-2-(3-methylbutanoylamino)-4-phenyl-thiophene-3-carboxamide

Systemtic Name: N,N-dicyclohexyl-2-(3-methylbutanoylamino)-4-phenyl-thiophene-3-carboxamide Openeye Name: N,N-dicyclohexyl-2-(3-methylbutanoylamino)-4-phenyl-thiophene-3-carboxamide CAS Name: N,N-dicyclohexyl-2-[(3-methyl-1-oxobutyl)amino]-4-phenyl-3-thiophenecarboxamide IUPAC Name: N,N-dicyclohexyl-2-(3-methylbutanoylamino)-4-phenylthiophene-3-carboxamide Traditional Name: N,N-dicyclohexyl-2-(isovalerylamino)-4-phenyl-thiophene-3-carboxamide Formula: C28H38N2O2S MolecularWeight: 466.67852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)N(C3CCCCC3)C4CCCCC4

Isomeric SMILES

CC(C)CC(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)N(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C28H38N2O2S/c1-20(2)18-25(31)29-27-26(24(19-33-27)21-12-6-3-7-13-21)28(32)30(22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3,6-7,12-13,19-20,22-23H,4-5,8-11,14-18H2,1-2H3,(H,29,31)