N-(furan-2-ylmethyl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-ethanamide Openeye Name: N-(2-furylmethyl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-acetamide CAS Name: N-(2-furanylmethyl)-2-[[1-[(4-nitrophenyl)methyl]-3-indolyl]thio]acetamide IUPAC Name: N-(furan-2-ylmethyl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanylacetamide Traditional Name: N-(2-furfuryl)-2-[[1-(4-nitrobenzyl)indol-3-yl]thio]acetamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)[N+](=O)[O-])SCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=CC=C(C=C3)[N+](=O)[O-])SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H19N3O4S/c26-22(23-12-18-4-3-11-29-18)15-30-21-14-24(20-6-2-1-5-19(20)21)13-16-7-9-17(10-8-16)25(27)28/h1-11,14H,12-13,15H2,(H,23,26)