4-[3-[(phenylmethyl)-propan-2-yl-amino]-3-pyridin-3-yl-prop-1-ynyl]benzamide

Systemtic Name: 4-[3-[(phenylmethyl)-propan-2-yl-amino]-3-pyridin-3-yl-prop-1-ynyl]benzamide Openeye Name: 4-[3-[benzyl(isopropyl)amino]-3-(3-pyridyl)prop-1-ynyl]benzamide CAS Name: 4-[3-[(phenylmethyl)-propan-2-ylamino]-3-(3-pyridinyl)prop-1-ynyl]benzamide IUPAC Name: 4-[3-[benzyl(propan-2-yl)amino]-3-pyridin-3-ylprop-1-ynyl]benzamide Traditional Name: 4-[3-[benzyl(isopropyl)amino]-3-(3-pyridyl)prop-1-ynyl]benzamide Formula: C25H25N3O MolecularWeight: 383.4855

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(C#CC2=CC=C(C=C2)C(=O)N)C3=CN=CC=C3

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(C#CC2=CC=C(C=C2)C(=O)N)C3=CN=CC=C3

InChI

InChI=1S/C25H25N3O/c1-19(2)28(18-21-7-4-3-5-8-21)24(23-9-6-16-27-17-23)15-12-20-10-13-22(14-11-20)25(26)29/h3-11,13-14,16-17,19,24H,18H2,1-2H3,(H2,26,29)