bis(azanyl)methylidene-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]azanium

Systemtic Name: bis(azanyl)methylidene-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]azanium Openeye Name: diaminomethylene-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]ammonium CAS Name: diaminomethylidene-[(Z)-1-[4-methoxy-3-[(2-pyrimidinylthio)methyl]phenyl]ethylideneamino]ammonium IUPAC Name: diaminomethylidene-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]azanium Traditional Name: diaminomethylene-[(Z)-1-[4-methoxy-3-[(2-pyrimidylthio)methyl]phenyl]ethylideneamino]ammonium Formula: C15H19N6OS+ MolecularWeight: 331.41596

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N[NH+]=C(N)N)C1=CC(=C(C=C1)OC)CSC2=NC=CC=N2

Isomeric SMILES

C/C(=N/[NH+]=C(N)N)/C1=CC(=C(C=C1)OC)CSC2=NC=CC=N2

InChI

InChI=1S/C15H18N6OS/c1-10(20-21-14(16)17)11-4-5-13(22-2)12(8-11)9-23-15-18-6-3-7-19-15/h3-8H,9H2,1-2H3,(H4,16,17,21)/p+1/b20-10-