5-[(2-methylphenyl)amino]-3-(morpholin-4-ylmethyl)-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[(2-methylphenyl)amino]-3-(morpholin-4-ylmethyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(2-methylanilino)-3-(morpholinomethyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-(2-methylanilino)-3-(4-morpholinylmethyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(2-methylanilino)-3-(morpholin-4-ylmethyl)-1,3,4-thiadiazole-2-thione Traditional Name: 3-(morpholinomethyl)-5-(o-toluidino)-1,3,4-thiadiazole-2-thione Formula: C14H18N4OS2 MolecularWeight: 322.44892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NN(C(=S)S2)CN3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1NC2=NN(C(=S)S2)CN3CCOCC3

InChI

InChI=1S/C14H18N4OS2/c1-11-4-2-3-5-12(11)15-13-16-18(14(20)21-13)10-17-6-8-19-9-7-17/h2-5H,6-10H2,1H3,(H,15,16)