2,2-dimethyl-1-phenyl-propane-1-thiol; 4-(2,2-dimethyl-1-phenyl-propyl)sulfanyl-3-oxidanylidene-butanamide

Systemtic Name: 2,2-dimethyl-1-phenyl-propane-1-thiol; 4-(2,2-dimethyl-1-phenyl-propyl)sulfanyl-3-oxidanylidene-butanamide Openeye Name: 2,2-dimethyl-1-phenyl-propane-1-thiol; 4-(2,2-dimethyl-1-phenyl-propyl)sulfanyl-3-oxo-butanamide CAS Name: 2,2-dimethyl-1-phenyl-1-propanethiol; 4-[(2,2-dimethyl-1-phenylpropyl)thio]-3-oxobutanamide IUPAC Name: 2,2-dimethyl-1-phenylpropane-1-thiol; 4-(2,2-dimethyl-1-phenylpropyl)sulfanyl-3-oxobutanamide Traditional Name: 2,2-dimethyl-1-phenyl-propane-1-thiol; 4-[(2,2-dimethyl-1-phenyl-propyl)thio]-3-keto-butyramide Formula: C26H37NO2S2 MolecularWeight: 459.70748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C1=CC=CC=C1)S.CC(C)(C)C(C1=CC=CC=C1)SCC(=O)CC(=O)N

Isomeric SMILES

CC(C)(C)C(C1=CC=CC=C1)S.CC(C)(C)C(C1=CC=CC=C1)SCC(=O)CC(=O)N

InChI

InChI=1S/C15H21NO2S.C11H16S/c1-15(2,3)14(11-7-5-4-6-8-11)19-10-12(17)9-13(16)18;1-11(2,3)10(12)9-7-5-4-6-8-9/h4-8,14H,9-10H2,1-3H3,(H2,16,18);4-8,10,12H,1-3H3