N-[2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)thio]-1,2-dihydroacenaphthylen-1-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-1,2-dihydroacenaphthylen-1-yl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)thio]acenaphthen-1-yl]-4-methyl-benzenesulfonamide Formula: C21H19N5O2S2 MolecularWeight: 437.53786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2C(C3=CC=CC4=C3C2=CC=C4)SC5=NN=CN5N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2C(C3=CC=CC4=C3C2=CC=C4)SC5=NN=CN5N

InChI

InChI=1S/C21H19N5O2S2/c1-13-8-10-15(11-9-13)30(27,28)25-19-16-6-2-4-14-5-3-7-17(18(14)16)20(19)29-21-24-23-12-26(21)22/h2-12,19-20,25H,22H2,1H3