N-[(2-azanyl-4,5-dimethoxy-phenyl)methyl]-3-pyridin-4-yl-1,2,4-thiadiazol-5-amine

Systemtic Name: N-[(2-azanyl-4,5-dimethoxy-phenyl)methyl]-3-pyridin-4-yl-1,2,4-thiadiazol-5-amine Openeye Name: N-[(2-amino-4,5-dimethoxy-phenyl)methyl]-3-(4-pyridyl)-1,2,4-thiadiazol-5-amine CAS Name: N-[(2-amino-4,5-dimethoxyphenyl)methyl]-3-pyridin-4-yl-1,2,4-thiadiazol-5-amine IUPAC Name: N-[(2-amino-4,5-dimethoxyphenyl)methyl]-3-pyridin-4-yl-1,2,4-thiadiazol-5-amine Traditional Name: (2-amino-4,5-dimethoxy-benzyl)-[3-(4-pyridyl)-1,2,4-thiadiazol-5-yl]amine Formula: C16H17N5O2S MolecularWeight: 343.40348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CNC2=NC(=NS2)C3=CC=NC=C3)N)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CNC2=NC(=NS2)C3=CC=NC=C3)N)OC

InChI

InChI=1S/C16H17N5O2S/c1-22-13-7-11(12(17)8-14(13)23-2)9-19-16-20-15(21-24-16)10-3-5-18-6-4-10/h3-8H,9,17H2,1-2H3,(H,19,20,21)