[3-[(4-nitrophenyl)methyl]-2-propylsulfanyl-imidazol-4-yl]methanol

Systemtic Name: [3-[(4-nitrophenyl)methyl]-2-propylsulfanyl-imidazol-4-yl]methanol Openeye Name: [3-[(4-nitrophenyl)methyl]-2-propylsulfanyl-imidazol-4-yl]methanol CAS Name: [3-[(4-nitrophenyl)methyl]-2-(propylthio)-4-imidazolyl]methanol IUPAC Name: [3-[(4-nitrophenyl)methyl]-2-propylsulfanylimidazol-4-yl]methanol Traditional Name: [3-(4-nitrobenzyl)-2-(propylthio)imidazol-4-yl]methanol Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])CO

Isomeric SMILES

CCCSC1=NC=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])CO

InChI

InChI=1S/C14H17N3O3S/c1-2-7-21-14-15-8-13(10-18)16(14)9-11-3-5-12(6-4-11)17(19)20/h3-6,8,18H,2,7,9-10H2,1H3