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

Systemtic Name: 1-methyl-3-[4-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenyl]thiourea Openeye Name: 1-methyl-3-[4-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]phenyl]thiourea CAS Name: 1-methyl-3-[4-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenyl]thiourea IUPAC Name: 1-methyl-3-[4-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methoxy]phenyl]thiourea Traditional Name: 1-methyl-3-[4-[(4-phenyl-5-thioxo-1H-1,2,4-triazol-3-yl)methoxy]phenyl]thiourea Formula: C17H17N5OS2 MolecularWeight: 371.47978

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC=C(C=C1)OCC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

CNC(=S)NC1=CC=C(C=C1)OCC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C17H17N5OS2/c1-18-16(24)19-12-7-9-14(10-8-12)23-11-15-20-21-17(25)22(15)13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,21,25)(H2,18,19,24)