N-[(4-fluorophenyl)methyl]-2-[(4-methoxyphenyl)carbamoyl-(2-pyrrolidin-1-ylethyl)amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-[(4-methoxyphenyl)carbamoyl-(2-pyrrolidin-1-ylethyl)amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-[(4-methoxyphenyl)carbamoyl-(2-pyrrolidin-1-ylethyl)amino]-N-(2-thienylmethyl)acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[[(4-methoxyanilino)-oxomethyl]-[2-(1-pyrrolidinyl)ethyl]amino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-[(4-methoxyphenyl)carbamoyl-(2-pyrrolidin-1-ylethyl)amino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-(4-fluorobenzyl)-2-[(4-methoxyphenyl)carbamoyl-(2-pyrrolidinoethyl)amino]-N-(2-thenyl)acetamide Formula: C28H33FN4O3S MolecularWeight: 524.650023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N(CCN2CCCC2)CC(=O)N(CC3=CC=C(C=C3)F)CC4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N(CCN2CCCC2)CC(=O)N(CC3=CC=C(C=C3)F)CC4=CC=CS4

InChI

InChI=1S/C28H33FN4O3S/c1-36-25-12-10-24(11-13-25)30-28(35)32(17-16-31-14-2-3-15-31)21-27(34)33(20-26-5-4-18-37-26)19-22-6-8-23(29)9-7-22/h4-13,18H,2-3,14-17,19-21H2,1H3,(H,30,35)