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

Systemtic Name: 3-(5-azanylpentyl)-2-naphthalen-1-ylimino-N-[(3-nitrophenyl)methyl]-1,3-thiazole-4-carboxamide Openeye Name: 3-(5-aminopentyl)-2-(1-naphthylimino)-N-[(3-nitrophenyl)methyl]thiazole-4-carboxamide CAS Name: 3-(5-aminopentyl)-2-(1-naphthalenylimino)-N-[(3-nitrophenyl)methyl]-4-thiazolecarboxamide IUPAC Name: 3-(5-aminopentyl)-2-naphthalen-1-ylimino-N-[(3-nitrophenyl)methyl]-1,3-thiazole-4-carboxamide Traditional Name: 3-(5-aminopentyl)-2-(1-naphthylimino)-N-(3-nitrobenzyl)-4-thiazoline-4-carboxamide Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2N=C3N(C(=CS3)C(=O)NCC4=CC(=CC=C4)[N+](=O)[O-])CCCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2N=C3N(C(=CS3)C(=O)NCC4=CC(=CC=C4)[N+](=O)[O-])CCCCCN

InChI

InChI=1S/C26H27N5O3S/c27-14-4-1-5-15-30-24(25(32)28-17-19-8-6-11-21(16-19)31(33)34)18-35-26(30)29-23-13-7-10-20-9-2-3-12-22(20)23/h2-3,6-13,16,18H,1,4-5,14-15,17,27H2,(H,28,32)