1-phenethyl-3-(1,2,4-triazol-4-yl)thiourea

Systemtic Name: 1-phenethyl-3-(1,2,4-triazol-4-yl)thiourea Openeye Name: 1-phenethyl-3-(1,2,4-triazol-4-yl)thiourea CAS Name: 1-phenethyl-3-(1,2,4-triazol-4-yl)thiourea IUPAC Name: 1-phenethyl-3-(1,2,4-triazol-4-yl)thiourea Traditional Name: 1-phenethyl-3-(1,2,4-triazol-4-yl)thiourea Formula: C11H13N5S MolecularWeight: 247.31942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=S)NN2C=NN=C2

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=S)NN2C=NN=C2

InChI

InChI=1S/C11H13N5S/c17-11(15-16-8-13-14-9-16)12-7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2,(H2,12,15,17)