1-[3-[(4-ethoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-propan-2-yl-urea

Systemtic Name: 1-[3-[(4-ethoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-propan-2-yl-urea Openeye Name: 1-[3-[(4-ethoxyphenyl)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]-3-isopropyl-urea CAS Name: 1-[3-[(4-ethoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-propan-2-ylurea IUPAC Name: 1-[3-[(4-ethoxyphenyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-3-propan-2-ylurea Traditional Name: 1-[3-(4-ethoxybenzyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-3-isopropyl-urea Formula: C15H21N5O2S MolecularWeight: 335.42454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=NNC(=S)N2NC(=O)NC(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=NNC(=S)N2NC(=O)NC(C)C

InChI

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