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

Systemtic Name: 5-[(3-methylphenyl)amino]-3-(morpholin-4-ylmethyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(3-methylanilino)-3-(morpholinomethyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-(3-methylanilino)-3-(4-morpholinylmethyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(3-methylanilino)-3-(morpholin-4-ylmethyl)-1,3,4-thiadiazole-2-thione Traditional Name: 3-(morpholinomethyl)-5-(m-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=C1)NC2=NN(C(=S)S2)CN3CCOCC3

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN(C(=S)S2)CN3CCOCC3

InChI

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