5-chloranyl-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]-2-nitro-benzamide

Systemtic Name: 5-chloranyl-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]-2-nitro-benzamide Openeye Name: 5-chloro-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]-2-nitro-benzamide CAS Name: 5-chloro-N-[2-[(2-methyl-1H-indol-3-yl)thio]ethyl]-2-nitrobenzamide IUPAC Name: 5-chloro-N-[2-[(2-methyl-1H-indol-3-yl)sulfanyl]ethyl]-2-nitrobenzamide Traditional Name: 5-chloro-N-[2-[(2-methyl-1H-indol-3-yl)thio]ethyl]-2-nitro-benzamide Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)SCCNC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)SCCNC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H16ClN3O3S/c1-11-17(13-4-2-3-5-15(13)21-11)26-9-8-20-18(23)14-10-12(19)6-7-16(14)22(24)25/h2-7,10,21H,8-9H2,1H3,(H,20,23)