2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-(5-tert-butyl-2-methyl-phenyl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-[(5-tert-butyl-2-methylphenyl)thio]-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-(5-tert-butyl-2-methylphenyl)sulfanyl-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-[(5-tert-butyl-2-methyl-phenyl)thio]-1-(1H-pyrrol-2-yl)ethanone Formula: C17H21NOS MolecularWeight: 287.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)SCC(=O)C2=CC=CN2

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)SCC(=O)C2=CC=CN2

InChI

InChI=1S/C17H21NOS/c1-12-7-8-13(17(2,3)4)10-16(12)20-11-15(19)14-6-5-9-18-14/h5-10,18H,11H2,1-4H3