2-[bis(methylsulfanyl)methylidene]-3-methyl-N-(3-phenylpropylcarbamoyl)butanamide

Systemtic Name: 2-[bis(methylsulfanyl)methylidene]-3-methyl-N-(3-phenylpropylcarbamoyl)butanamide Openeye Name: 2-[bis(methylsulfanyl)methylene]-3-methyl-N-(3-phenylpropylcarbamoyl)butanamide CAS Name: 2-[bis(methylthio)methylidene]-3-methyl-N-[oxo-(3-phenylpropylamino)methyl]butanamide IUPAC Name: 2-[bis(methylsulfanyl)methylidene]-3-methyl-N-(3-phenylpropylcarbamoyl)butanamide Traditional Name: 2-isopropyl-3,3-bis(methylthio)-N-(3-phenylpropylcarbamoyl)acrylamide Formula: C18H26N2O2S2 MolecularWeight: 366.54124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C(SC)SC)C(=O)NC(=O)NCCCC1=CC=CC=C1

Isomeric SMILES

CC(C)C(=C(SC)SC)C(=O)NC(=O)NCCCC1=CC=CC=C1

InChI

InChI=1S/C18H26N2O2S2/c1-13(2)15(17(23-3)24-4)16(21)20-18(22)19-12-8-11-14-9-6-5-7-10-14/h5-7,9-10,13H,8,11-12H2,1-4H3,(H2,19,20,21,22)