3-(5-azanylpentyl)-2-(3,5-dimethylphenyl)imino-N-(naphthalen-1-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 3-(5-azanylpentyl)-2-(3,5-dimethylphenyl)imino-N-(naphthalen-1-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 3-(5-aminopentyl)-2-(3,5-dimethylphenyl)imino-N-(1-naphthylmethyl)thiazole-4-carboxamide CAS Name: 3-(5-aminopentyl)-2-(3,5-dimethylphenyl)imino-N-(1-naphthalenylmethyl)-4-thiazolecarboxamide IUPAC Name: 3-(5-aminopentyl)-2-(3,5-dimethylphenyl)imino-N-(naphthalen-1-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 3-(5-aminopentyl)-2-(3,5-dimethylphenyl)imino-N-(1-naphthylmethyl)-4-thiazoline-4-carboxamide Formula: C28H32N4OS MolecularWeight: 472.64488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N=C2N(C(=CS2)C(=O)NCC3=CC=CC4=CC=CC=C43)CCCCCN)C

Isomeric SMILES

CC1=CC(=CC(=C1)N=C2N(C(=CS2)C(=O)NCC3=CC=CC4=CC=CC=C43)CCCCCN)C

InChI

InChI=1S/C28H32N4OS/c1-20-15-21(2)17-24(16-20)31-28-32(14-7-3-6-13-29)26(19-34-28)27(33)30-18-23-11-8-10-22-9-4-5-12-25(22)23/h4-5,8-12,15-17,19H,3,6-7,13-14,18,29H2,1-2H3,(H,30,33)