2-[(3-cyanophenyl)carbamoyl-cyclopropyl-amino]-N-[(4-fluorophenyl)methyl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(3-cyanophenyl)carbamoyl-cyclopropyl-amino]-N-[(4-fluorophenyl)methyl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[(3-cyanophenyl)carbamoyl-cyclopropyl-amino]-N-[(4-fluorophenyl)methyl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(3-cyanoanilino)-oxomethyl]-cyclopropylamino]-N-[(4-fluorophenyl)methyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(3-cyanophenyl)carbamoyl-cyclopropylamino]-N-[(4-fluorophenyl)methyl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(3-cyanophenyl)carbamoyl-cyclopropyl-amino]-N-(4-fluorobenzyl)-N-(2-thenyl)acetamide Formula: C25H23FN4O2S MolecularWeight: 462.539123

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3)C(=O)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CC1N(CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3)C(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H23FN4O2S/c26-20-8-6-18(7-9-20)15-29(16-23-5-2-12-33-23)24(31)17-30(22-10-11-22)25(32)28-21-4-1-3-19(13-21)14-27/h1-9,12-13,22H,10-11,15-17H2,(H,28,32)