1-(3-methoxy-4-prop-2-ynoxy-phenyl)-N-(pyridin-3-ylmethyl)-N-(thiophen-2-ylmethyl)methanamine

Systemtic Name: 1-(3-methoxy-4-prop-2-ynoxy-phenyl)-N-(pyridin-3-ylmethyl)-N-(thiophen-2-ylmethyl)methanamine Openeye Name: 1-(3-methoxy-4-prop-2-ynoxy-phenyl)-N-(3-pyridylmethyl)-N-(2-thienylmethyl)methanamine CAS Name: 1-(3-methoxy-4-prop-2-ynoxyphenyl)-N-(3-pyridinylmethyl)-N-(thiophen-2-ylmethyl)methanamine IUPAC Name: 1-(3-methoxy-4-prop-2-ynoxyphenyl)-N-(pyridin-3-ylmethyl)-N-(thiophen-2-ylmethyl)methanamine Traditional Name: (3-methoxy-4-propargyloxy-benzyl)-(3-pyridylmethyl)-(2-thenyl)amine Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(CC2=CN=CC=C2)CC3=CC=CS3)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)CN(CC2=CN=CC=C2)CC3=CC=CS3)OCC#C

InChI

InChI=1S/C22H22N2O2S/c1-3-11-26-21-9-8-18(13-22(21)25-2)15-24(17-20-7-5-12-27-20)16-19-6-4-10-23-14-19/h1,4-10,12-14H,11,15-17H2,2H3