2-[4-[4-[[2-(methylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]butyl]-1,3-thiazol-2-yl]guanidine

Systemtic Name: 2-[4-[4-[[2-(methylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]butyl]-1,3-thiazol-2-yl]guanidine Openeye Name: 2-[4-[4-[[2-(methylamino)-3,4-dioxo-cyclobuten-1-yl]amino]butyl]thiazol-2-yl]guanidine CAS Name: 2-[4-[4-[[2-(methylamino)-3,4-dioxo-1-cyclobutenyl]amino]butyl]-2-thiazolyl]guanidine IUPAC Name: 2-[4-[4-[[2-(methylamino)-3,4-dioxocyclobuten-1-yl]amino]butyl]-1,3-thiazol-2-yl]guanidine Traditional Name: 2-[4-[4-[[3,4-diketo-2-(methylamino)cyclobuten-1-yl]amino]butyl]thiazol-2-yl]guanidine Formula: C13H18N6O2S MolecularWeight: 322.38602

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=O)C1=O)NCCCCC2=CSC(=N2)N=C(N)N

Isomeric SMILES

CNC1=C(C(=O)C1=O)NCCCCC2=CSC(=N2)N=C(N)N

InChI

InChI=1S/C13H18N6O2S/c1-16-8-9(11(21)10(8)20)17-5-3-2-4-7-6-22-13(18-7)19-12(14)15/h6,16-17H,2-5H2,1H3,(H4,14,15,18,19)