(2S)-N-(3-ethynylphenyl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: (2S)-N-(3-ethynylphenyl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: (2S)-N-(3-ethynylphenyl)-3-methyl-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: (2S)-N-(3-ethynylphenyl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: (2S)-N-(3-ethynylphenyl)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: (2S)-N-(3-ethynylphenyl)-3-methyl-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)C#C)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=CC(=C1)C#C)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H22N2O3S/c1-4-17-11-8-12-19(15-17)22-21(24)20(16(2)3)23-27(25,26)14-13-18-9-6-5-7-10-18/h1,5-16,20,23H,2-3H3,(H,22,24)/b14-13+/t20-/m0/s1