2-[5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-2-ylmethyl)imidazol-2-yl]ethanamine

Systemtic Name: 2-[5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-2-ylmethyl)imidazol-2-yl]ethanamine Openeye Name: 2-[4-isopropyl-5-(3-nitrophenyl)sulfanyl-1-(2-pyridylmethyl)imidazol-2-yl]ethanamine CAS Name: 2-[5-[(3-nitrophenyl)thio]-4-propan-2-yl-1-(2-pyridinylmethyl)-2-imidazolyl]ethanamine IUPAC Name: 2-[5-(3-nitrophenyl)sulfanyl-4-propan-2-yl-1-(pyridin-2-ylmethyl)imidazol-2-yl]ethanamine Traditional Name: 2-[4-isopropyl-5-[(3-nitrophenyl)thio]-1-(2-pyridylmethyl)imidazol-2-yl]ethylamine Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=N1)CCN)CC2=CC=CC=N2)SC3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(N(C(=N1)CCN)CC2=CC=CC=N2)SC3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N5O2S/c1-14(2)19-20(28-17-8-5-7-16(12-17)25(26)27)24(18(23-19)9-10-21)13-15-6-3-4-11-22-15/h3-8,11-12,14H,9-10,13,21H2,1-2H3