3-(5-azanylpentyl)-2-(3,5-dimethylphenyl)imino-N-[(3-methylphenyl)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 3-(5-azanylpentyl)-2-(3,5-dimethylphenyl)imino-N-[(3-methylphenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 3-(5-aminopentyl)-2-(3,5-dimethylphenyl)imino-N-(m-tolylmethyl)thiazole-4-carboxamide CAS Name: 3-(5-aminopentyl)-2-(3,5-dimethylphenyl)imino-N-[(3-methylphenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 3-(5-aminopentyl)-2-(3,5-dimethylphenyl)imino-N-[(3-methylphenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 3-(5-aminopentyl)-2-(3,5-dimethylphenyl)imino-N-(3-methylbenzyl)-4-thiazoline-4-carboxamide Formula: C25H32N4OS MolecularWeight: 436.61278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=CSC(=NC3=CC(=CC(=C3)C)C)N2CCCCCN

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=CSC(=NC3=CC(=CC(=C3)C)C)N2CCCCCN

InChI

InChI=1S/C25H32N4OS/c1-18-8-7-9-21(13-18)16-27-24(30)23-17-31-25(29(23)11-6-4-5-10-26)28-22-14-19(2)12-20(3)15-22/h7-9,12-15,17H,4-6,10-11,16,26H2,1-3H3,(H,27,30)