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

Systemtic Name: 3-(5-azanylpentyl)-N-[(3-methylphenyl)methyl]-2-naphthalen-1-ylimino-1,3-thiazole-4-carboxamide Openeye Name: 3-(5-aminopentyl)-N-(m-tolylmethyl)-2-(1-naphthylimino)thiazole-4-carboxamide CAS Name: 3-(5-aminopentyl)-N-[(3-methylphenyl)methyl]-2-(1-naphthalenylimino)-4-thiazolecarboxamide IUPAC Name: 3-(5-aminopentyl)-N-[(3-methylphenyl)methyl]-2-naphthalen-1-ylimino-1,3-thiazole-4-carboxamide Traditional Name: 3-(5-aminopentyl)-N-(3-methylbenzyl)-2-(1-naphthylimino)-4-thiazoline-4-carboxamide Formula: C27H30N4OS MolecularWeight: 458.6183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)C2=CSC(=NC3=CC=CC4=CC=CC=C43)N2CCCCCN

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)C2=CSC(=NC3=CC=CC4=CC=CC=C43)N2CCCCCN

InChI

InChI=1S/C27H30N4OS/c1-20-9-7-10-21(17-20)18-29-26(32)25-19-33-27(31(25)16-6-2-5-15-28)30-24-14-8-12-22-11-3-4-13-23(22)24/h3-4,7-14,17,19H,2,5-6,15-16,18,28H2,1H3,(H,29,32)