5-(2-methylfuran-3-yl)-2-(morpholin-4-ylmethyl)-4-(phenylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-(2-methylfuran-3-yl)-2-(morpholin-4-ylmethyl)-4-(phenylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-5-(2-methyl-3-furyl)-2-(morpholinomethyl)-1,2,4-triazole-3-thione CAS Name: 5-(2-methyl-3-furanyl)-2-(4-morpholinylmethyl)-4-(phenylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-5-(2-methylfuran-3-yl)-2-(morpholin-4-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-5-(2-methyl-3-furyl)-2-(morpholinomethyl)-1,2,4-triazole-3-thione Formula: C19H22N4O2S MolecularWeight: 370.46858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN(C(=S)N2CC3=CC=CC=C3)CN4CCOCC4

Isomeric SMILES

CC1=C(C=CO1)C2=NN(C(=S)N2CC3=CC=CC=C3)CN4CCOCC4

InChI

InChI=1S/C19H22N4O2S/c1-15-17(7-10-25-15)18-20-23(14-21-8-11-24-12-9-21)19(26)22(18)13-16-5-3-2-4-6-16/h2-7,10H,8-9,11-14H2,1H3