N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-ethanamide Openeye Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanyl-acetamide CAS Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-2-[[1-[(4-nitrophenyl)methyl]-3-indolyl]thio]acetamide IUPAC Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-[1-[(4-nitrophenyl)methyl]indol-3-yl]sulfanylacetamide Traditional Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-2-[[1-(4-nitrobenzyl)indol-3-yl]thio]acetamide Formula: C21H19N5O3S3 MolecularWeight: 485.60226

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)CSC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O3S3/c1-2-30-21-24-23-20(32-21)22-19(27)13-31-18-12-25(17-6-4-3-5-16(17)18)11-14-7-9-15(10-8-14)26(28)29/h3-10,12H,2,11,13H2,1H3,(H,22,23,27)