N-[5-[(4-chlorophenyl)methylsulfanyl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-5-pyridin-2-yl-thiophene-2-sulfonamide

Systemtic Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-5-pyridin-2-yl-thiophene-2-sulfonamide Openeye Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-5-(2-pyridyl)thiophene-2-sulfonamide CAS Name: N-[5-[(4-chlorophenyl)methylthio]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-5-(2-pyridinyl)-2-thiophenesulfonamide IUPAC Name: N-[5-[(4-chlorophenyl)methylsulfanyl]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-5-pyridin-2-ylthiophene-2-sulfonamide Traditional Name: N-[5-[(4-chlorobenzyl)thio]-1,2-diaza-4-azanidacyclopenta-2,5-dien-3-yl]-5-(2-pyridyl)thiophene-2-sulfonamide Formula: C18H13ClN5O2S3- MolecularWeight: 462.97612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=C(S2)S(=O)(=O)NC3=NN=C([N-]3)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=C(S2)S(=O)(=O)NC3=NN=C([N-]3)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H13ClN5O2S3/c19-13-6-4-12(5-7-13)11-27-18-21-17(22-23-18)24-29(25,26)16-9-8-15(28-16)14-3-1-2-10-20-14/h1-10H,11H2,(H-,21,22,23,24)/q-1