2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[2-[(4-nitrophenyl)amino]ethyl]ethanamide

Systemtic Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[2-[(4-nitrophenyl)amino]ethyl]ethanamide Openeye Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[2-(4-nitroanilino)ethyl]acetamide CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-[2-(4-nitroanilino)ethyl]acetamide IUPAC Name: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[2-(4-nitroanilino)ethyl]acetamide Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]-N-[2-(4-nitroanilino)ethyl]acetamide Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O3S/c1-12-2-7-15-16(10-12)22-18(21-15)27-11-17(24)20-9-8-19-13-3-5-14(6-4-13)23(25)26/h2-7,10,19H,8-9,11H2,1H3,(H,20,24)(H,21,22)