2-(methoxymethyl)-5-[(4-nitrophenyl)methyl]-4-pentyl-1,3-thiazole

Systemtic Name: 2-(methoxymethyl)-5-[(4-nitrophenyl)methyl]-4-pentyl-1,3-thiazole Openeye Name: 2-(methoxymethyl)-5-[(4-nitrophenyl)methyl]-4-pentyl-thiazole CAS Name: 2-(methoxymethyl)-5-[(4-nitrophenyl)methyl]-4-pentylthiazole IUPAC Name: 2-(methoxymethyl)-5-[(4-nitrophenyl)methyl]-4-pentyl-1,3-thiazole Traditional Name: 4-amyl-2-(methoxymethyl)-5-(4-nitrobenzyl)thiazole Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(SC(=N1)COC)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=C(SC(=N1)COC)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H22N2O3S/c1-3-4-5-6-15-16(23-17(18-15)12-22-2)11-13-7-9-14(10-8-13)19(20)21/h7-10H,3-6,11-12H2,1-2H3