1-[4-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenyl]-3-methyl-thiourea

Systemtic Name: 1-[4-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenyl]-3-methyl-thiourea Openeye Name: 1-[4-[(4-ethyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]phenyl]-3-methyl-thiourea CAS Name: 1-[4-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenyl]-3-methylthiourea IUPAC Name: 1-[4-[(4-ethyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenyl]-3-methylthiourea Traditional Name: 1-[4-[(4-ethyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]phenyl]-3-methyl-thiourea Formula: C13H17N5OS2 MolecularWeight: 323.43698

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NNC1=S)COC2=CC=C(C=C2)NC(=S)NC

Isomeric SMILES

CCN1C(=NNC1=S)COC2=CC=C(C=C2)NC(=S)NC

InChI

InChI=1S/C13H17N5OS2/c1-3-18-11(16-17-13(18)21)8-19-10-6-4-9(5-7-10)15-12(20)14-2/h4-7H,3,8H2,1-2H3,(H,17,21)(H2,14,15,20)