1-[5-(2-methylbutyl)-4-(4-nitrophenyl)sulfanyl-1H-imidazol-2-yl]ethyl carbamate

Systemtic Name: 1-[5-(2-methylbutyl)-4-(4-nitrophenyl)sulfanyl-1H-imidazol-2-yl]ethyl carbamate Openeye Name: 1-[5-(2-methylbutyl)-4-(4-nitrophenyl)sulfanyl-1H-imidazol-2-yl]ethyl carbamate CAS Name: carbamic acid 1-[5-(2-methylbutyl)-4-[(4-nitrophenyl)thio]-1H-imidazol-2-yl]ethyl ester IUPAC Name: 1-[5-(2-methylbutyl)-4-(4-nitrophenyl)sulfanyl-1H-imidazol-2-yl]ethyl carbamate Traditional Name: carbamic acid 1-[5-(2-methylbutyl)-4-[(4-nitrophenyl)thio]-1H-imidazol-2-yl]ethyl ester Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=C(N=C(N1)C(C)OC(=O)N)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)CC1=C(N=C(N1)C(C)OC(=O)N)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O4S/c1-4-10(2)9-14-16(20-15(19-14)11(3)25-17(18)22)26-13-7-5-12(6-8-13)21(23)24/h5-8,10-11H,4,9H2,1-3H3,(H2,18,22)(H,19,20)