2-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]ethanenitrile

Systemtic Name: 2-[[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]ethanenitrile Openeye Name: 2-[[3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methylamino]acetonitrile CAS Name: 2-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]acetonitrile IUPAC Name: 2-[[3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methylamino]acetonitrile Traditional Name: 2-[[3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]amino]acetonitrile Formula: C15H15ClN2O2S MolecularWeight: 322.8098

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCC#N)Cl)OCC2=CC=CS2

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCC#N)Cl)OCC2=CC=CS2

InChI

InChI=1S/C15H15ClN2O2S/c1-19-14-8-11(9-18-5-4-17)7-13(16)15(14)20-10-12-3-2-6-21-12/h2-3,6-8,18H,5,9-10H2,1H3