2-[[(2S)-2-(3,4-dimethylphenoxy)butanoyl]amino]-4-phenyl-N-propan-2-yl-thiophene-3-carboxamide

Systemtic Name: 2-[[(2S)-2-(3,4-dimethylphenoxy)butanoyl]amino]-4-phenyl-N-propan-2-yl-thiophene-3-carboxamide Openeye Name: 2-[[(2S)-2-(3,4-dimethylphenoxy)butanoyl]amino]-N-isopropyl-4-phenyl-thiophene-3-carboxamide CAS Name: 2-[[(2S)-2-(3,4-dimethylphenoxy)-1-oxobutyl]amino]-4-phenyl-N-propan-2-yl-3-thiophenecarboxamide IUPAC Name: 2-[[(2S)-2-(3,4-dimethylphenoxy)butanoyl]amino]-4-phenyl-N-propan-2-ylthiophene-3-carboxamide Traditional Name: 2-[[(2S)-2-(3,4-dimethylphenoxy)butanoyl]amino]-N-isopropyl-4-phenyl-thiophene-3-carboxamide Formula: C26H30N2O3S MolecularWeight: 450.593

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)NC(C)C)OC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC[C@@H](C(=O)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)NC(C)C)OC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C26H30N2O3S/c1-6-22(31-20-13-12-17(4)18(5)14-20)24(29)28-26-23(25(30)27-16(2)3)21(15-32-26)19-10-8-7-9-11-19/h7-16,22H,6H2,1-5H3,(H,27,30)(H,28,29)/t22-/m0/s1