(E)-N-[2-(piperidin-1-ylmethyl)quinazolin-4-yl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-(piperidin-1-ylmethyl)quinazolin-4-yl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[2-(1-piperidylmethyl)quinazolin-4-yl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[2-(1-piperidinylmethyl)-4-quinazolinyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[2-(piperidin-1-ylmethyl)quinazolin-4-yl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[2-(piperidinomethyl)quinazolin-4-yl]-3-(2-thienyl)acrylamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=NC3=CC=CC=C3C(=N2)NC(=O)C=CC4=CC=CS4

Isomeric SMILES

C1CCN(CC1)CC2=NC3=CC=CC=C3C(=N2)NC(=O)/C=C/C4=CC=CS4

InChI

InChI=1S/C21H22N4OS/c26-20(11-10-16-7-6-14-27-16)24-21-17-8-2-3-9-18(17)22-19(23-21)15-25-12-4-1-5-13-25/h2-3,6-11,14H,1,4-5,12-13,15H2,(H,22,23,24,26)/b11-10+