(2R)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-[4-(3-nitrophenyl)-2-thiazolyl]-2-[(1-phenethyl-2-benzimidazolyl)thio]propanamide IUPAC Name: (2R)-N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(1-phenethylbenzimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-[4-(3-nitrophenyl)thiazol-2-yl]-2-[(1-phenethylbenzimidazol-2-yl)thio]propionamide Formula: C27H23N5O3S2 MolecularWeight: 529.63322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4N3CCC5=CC=CC=C5

Isomeric SMILES

C[C@H](C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4N3CCC5=CC=CC=C5

InChI

InChI=1S/C27H23N5O3S2/c1-18(25(33)30-26-28-23(17-36-26)20-10-7-11-21(16-20)32(34)35)37-27-29-22-12-5-6-13-24(22)31(27)15-14-19-8-3-2-4-9-19/h2-13,16-18H,14-15H2,1H3,(H,28,30,33)/t18-/m1/s1