N-[2-[4-[2-[(5-azanylidene-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]ethanoyl]phenyl]ethyl]methanesulfonamide

Systemtic Name: N-[2-[4-[2-[(5-azanylidene-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]ethanoyl]phenyl]ethyl]methanesulfonamide Openeye Name: N-[2-[4-[2-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]acetyl]phenyl]ethyl]methanesulfonamide CAS Name: N-[2-[4-[2-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)thio]-1-oxoethyl]phenyl]ethyl]methanesulfonamide IUPAC Name: N-[2-[4-[2-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)sulfanyl]acetyl]phenyl]ethyl]methanesulfonamide Traditional Name: N-[2-[4-[2-[(5-imino-1-thia-3-aza-4-azanidacyclopent-2-en-2-yl)thio]acetyl]phenyl]ethyl]methanesulfonamide Formula: C13H15N4O3S3- MolecularWeight: 371.4782

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCC1=CC=C(C=C1)C(=O)CSC2=N[N-]C(=N)S2

Isomeric SMILES

CS(=O)(=O)NCCC1=CC=C(C=C1)C(=O)CSC2=N[N-]C(=N)S2

InChI

InChI=1S/C13H15N4O3S3/c1-23(19,20)15-7-6-9-2-4-10(5-3-9)11(18)8-21-13-17-16-12(14)22-13/h2-5,15H,6-8H2,1H3,(H-,14,16)/q-1