2-(2-azanyl-4-methyl-phenyl)sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide

Systemtic Name: 2-(2-azanyl-4-methyl-phenyl)sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: 2-(2-amino-4-methyl-phenyl)sulfanyl-N-(isopentylcarbamoyl)acetamide CAS Name: 2-[(2-amino-4-methylphenyl)thio]-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-(2-amino-4-methylphenyl)sulfanyl-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-[(2-amino-4-methyl-phenyl)thio]-N-(isoamylcarbamoyl)acetamide Formula: C15H23N3O2S MolecularWeight: 309.42702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)NC(=O)NCCC(C)C)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)NC(=O)NCCC(C)C)N

InChI

InChI=1S/C15H23N3O2S/c1-10(2)6-7-17-15(20)18-14(19)9-21-13-5-4-11(3)8-12(13)16/h4-5,8,10H,6-7,9,16H2,1-3H3,(H2,17,18,19,20)