N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-(2-morpholin-4-ylethyl)-4-nitro-benzamide

Systemtic Name: N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-N-(2-morpholin-4-ylethyl)-4-nitro-benzamide Openeye Name: N-[2-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-N-(2-morpholinoethyl)-4-nitro-benzamide CAS Name: N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-[2-(4-morpholinyl)ethyl]-4-nitrobenzamide IUPAC Name: N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(2-morpholin-4-ylethyl)-4-nitrobenzamide Traditional Name: N-[2-[(4-fluorobenzyl)-(2-thenyl)amino]-2-keto-ethyl]-N-(2-morpholinoethyl)-4-nitro-benzamide Formula: C27H29FN4O5S MolecularWeight: 540.606363

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN(CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCN(CC(=O)N(CC2=CC=C(C=C2)F)CC3=CC=CS3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H29FN4O5S/c28-23-7-3-21(4-8-23)18-31(19-25-2-1-17-38-25)26(33)20-30(12-11-29-13-15-37-16-14-29)27(34)22-5-9-24(10-6-22)32(35)36/h1-10,17H,11-16,18-20H2