N-[3-[(2,3-dimethoxyphenyl)-(pyridin-2-ylamino)methyl]-5-ethyl-thiophen-2-yl]benzamide

Systemtic Name: N-[3-[(2,3-dimethoxyphenyl)-(pyridin-2-ylamino)methyl]-5-ethyl-thiophen-2-yl]benzamide Openeye Name: N-[3-[(2,3-dimethoxyphenyl)-(2-pyridylamino)methyl]-5-ethyl-2-thienyl]benzamide CAS Name: N-[3-[(2,3-dimethoxyphenyl)-(2-pyridinylamino)methyl]-5-ethyl-2-thiophenyl]benzamide IUPAC Name: N-[3-[(2,3-dimethoxyphenyl)-(pyridin-2-ylamino)methyl]-5-ethylthiophen-2-yl]benzamide Traditional Name: N-[3-[(2,3-dimethoxyphenyl)-(2-pyridylamino)methyl]-5-ethyl-2-thienyl]benzamide Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=C(C(=CC=C3)OC)OC)NC4=CC=CC=N4

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC=CC=C2)C(C3=C(C(=CC=C3)OC)OC)NC4=CC=CC=N4

InChI

InChI=1S/C27H27N3O3S/c1-4-19-17-21(27(34-19)30-26(31)18-11-6-5-7-12-18)24(29-23-15-8-9-16-28-23)20-13-10-14-22(32-2)25(20)33-3/h5-17,24H,4H2,1-3H3,(H,28,29)(H,30,31)