1-(3-methylbutyl)-N-(3-methyl-2-sulfanyl-phenyl)cyclohexane-1-carboxamide

Systemtic Name: 1-(3-methylbutyl)-N-(3-methyl-2-sulfanyl-phenyl)cyclohexane-1-carboxamide Openeye Name: 1-isopentyl-N-(3-methyl-2-sulfanyl-phenyl)cyclohexanecarboxamide CAS Name: N-(2-mercapto-3-methylphenyl)-1-(3-methylbutyl)-1-cyclohexanecarboxamide IUPAC Name: 1-(3-methylbutyl)-N-(3-methyl-2-sulfanylphenyl)cyclohexane-1-carboxamide Traditional Name: 1-isoamyl-N-(2-mercapto-3-methyl-phenyl)cyclohexanecarboxamide Formula: C19H29NOS MolecularWeight: 319.50466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2(CCCCC2)CCC(C)C)S

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2(CCCCC2)CCC(C)C)S

InChI

InChI=1S/C19H29NOS/c1-14(2)10-13-19(11-5-4-6-12-19)18(21)20-16-9-7-8-15(3)17(16)22/h7-9,14,22H,4-6,10-13H2,1-3H3,(H,20,21)