ethyl N'-[(E)-(3,5-dimethoxyphenyl)methylideneamino]carbamimidothioate

Systemtic Name: ethyl N'-[(E)-(3,5-dimethoxyphenyl)methylideneamino]carbamimidothioate Openeye Name: 3-[(E)-(3,5-dimethoxyphenyl)methyleneamino]-2-ethyl-isothiourea CAS Name: N'-[(E)-(3,5-dimethoxyphenyl)methylideneamino]carbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-[(E)-(3,5-dimethoxyphenyl)methylideneamino]carbamimidothioate Traditional Name: 3-[(E)-(3,5-dimethoxybenzylidene)amino]-2-ethyl-isothiourea Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NN=CC1=CC(=CC(=C1)OC)OC)N

Isomeric SMILES

CCS/C(=N/N=C/C1=CC(=CC(=C1)OC)OC)/N

InChI

InChI=1S/C12H17N3O2S/c1-4-18-12(13)15-14-8-9-5-10(16-2)7-11(6-9)17-3/h5-8H,4H2,1-3H3,(H2,13,15)/b14-8+