5-(benzotriazol-1-ylmethyl)-2-(morpholin-4-ylmethyl)-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(benzotriazol-1-ylmethyl)-2-(morpholin-4-ylmethyl)-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-(benzotriazol-1-ylmethyl)-2-(morpholinomethyl)-1,2,4-triazole-3-thione CAS Name: 5-(1-benzotriazolylmethyl)-2-(4-morpholinylmethyl)-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 5-(benzotriazol-1-ylmethyl)-2-(morpholin-4-ylmethyl)-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-(benzotriazol-1-ylmethyl)-2-(morpholinomethyl)-1,2,4-triazole-3-thione Formula: C17H21N7OS MolecularWeight: 371.45994

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN(C1=S)CN2CCOCC2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C=CCN1C(=NN(C1=S)CN2CCOCC2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C17H21N7OS/c1-2-7-22-16(12-23-15-6-4-3-5-14(15)18-20-23)19-24(17(22)26)13-21-8-10-25-11-9-21/h2-6H,1,7-13H2