[5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-propyl-imidazol-2-yl]methanol

Systemtic Name: [5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-propyl-imidazol-2-yl]methanol Openeye Name: [4-isopropyl-5-(3-nitrophenyl)sulfanyl-1-propyl-imidazol-2-yl]methanol CAS Name: [5-[(3-nitrophenyl)thio]-4-propan-2-yl-1-propyl-2-imidazolyl]methanol IUPAC Name: [5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-propylimidazol-2-yl]methanol Traditional Name: [4-isopropyl-5-[(3-nitrophenyl)thio]-1-propyl-imidazol-2-yl]methanol Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NC(=C1SC2=CC=CC(=C2)[N+](=O)[O-])C(C)C)CO

Isomeric SMILES

CCCN1C(=NC(=C1SC2=CC=CC(=C2)[N+](=O)[O-])C(C)C)CO

InChI

InChI=1S/C16H21N3O3S/c1-4-8-18-14(10-20)17-15(11(2)3)16(18)23-13-7-5-6-12(9-13)19(21)22/h5-7,9,11,20H,4,8,10H2,1-3H3