4-[(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxymethyl]benzenecarbonitrile

Systemtic Name: 4-[(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxymethyl]benzenecarbonitrile Openeye Name: 4-[(6-morpholinosulfonylbenzotriazol-1-yl)oxymethyl]benzonitrile CAS Name: 4-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxymethyl]benzonitrile IUPAC Name: 4-[(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxymethyl]benzonitrile Traditional Name: 4-[(6-morpholinosulfonylbenzotriazol-1-yl)oxymethyl]benzonitrile Formula: C18H17N5O4S MolecularWeight: 399.42368

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C18H17N5O4S/c19-12-14-1-3-15(4-2-14)13-27-23-18-11-16(5-6-17(18)20-21-23)28(24,25)22-7-9-26-10-8-22/h1-6,11H,7-10,13H2