[4-[5-[2,6-bis(oxidanylidene)piperidin-1-yl]pentylsulfanyl]phenyl] 4-[bis(azanyl)methylideneamino]benzoate

Systemtic Name: [4-[5-[2,6-bis(oxidanylidene)piperidin-1-yl]pentylsulfanyl]phenyl] 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: [4-[5-(2,6-dioxo-1-piperidyl)pentylsulfanyl]phenyl] 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid [4-[5-(2,6-dioxo-1-piperidinyl)pentylthio]phenyl] ester IUPAC Name: [4-[5-(2,6-dioxopiperidin-1-yl)pentylsulfanyl]phenyl] 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid [4-(5-glutarimidopentylthio)phenyl] ester Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C(=O)C1)CCCCCSC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)N=C(N)N

Isomeric SMILES

C1CC(=O)N(C(=O)C1)CCCCCSC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)N=C(N)N

InChI

InChI=1S/C24H28N4O4S/c25-24(26)27-18-9-7-17(8-10-18)23(31)32-19-11-13-20(14-12-19)33-16-3-1-2-15-28-21(29)5-4-6-22(28)30/h7-14H,1-6,15-16H2,(H4,25,26,27)