1-[2-(diethoxymethyl)-1,2,4-triazol-3-yl]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[2-(diethoxymethyl)-1,2,4-triazol-3-yl]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[2-(diethoxymethyl)-1,2,4-triazol-3-yl]thiourea CAS Name: 1-[2-(diethoxymethyl)-1,2,4-triazol-3-yl]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[2-(diethoxymethyl)-1,2,4-triazol-3-yl]thiourea Traditional Name: 1-benzyl-3-[2-(diethoxymethyl)-1,2,4-triazol-3-yl]thiourea Formula: C15H21N5O2S MolecularWeight: 335.42454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(N1C(=NC=N1)NC(=S)NCC2=CC=CC=C2)OCC

Isomeric SMILES

CCOC(N1C(=NC=N1)NC(=S)NCC2=CC=CC=C2)OCC

InChI

InChI=1S/C15H21N5O2S/c1-3-21-15(22-4-2)20-13(17-11-18-20)19-14(23)16-10-12-8-6-5-7-9-12/h5-9,11,15H,3-4,10H2,1-2H3,(H2,16,17,18,19,23)