2-(1-azanyl-3-methylsulfanyl-propyl)-N-[(3-methylphenyl)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-[(3-methylphenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-(m-tolylmethyl)thiazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[(3-methylphenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[(3-methylphenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-(3-methylbenzyl)thiazole-4-carboxamide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=CSC(=N2)C(CCSC)N

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=CSC(=N2)C(CCSC)N

InChI

InChI=1S/C16H21N3OS2/c1-11-4-3-5-12(8-11)9-18-15(20)14-10-22-16(19-14)13(17)6-7-21-2/h3-5,8,10,13H,6-7,9,17H2,1-2H3,(H,18,20)