N-butan-2-yl-4-chloranyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-butan-2-yl-4-chloranyl-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-[(4-fluorophenyl)methyl-(2-thienylmethyl)amino]-2-oxo-ethyl]-3-nitro-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-chloro-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-butan-2-yl-4-chloro-N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-[(4-fluorobenzyl)-(2-thenyl)amino]-2-keto-ethyl]-3-nitro-N-sec-butyl-benzamide Formula: C25H25ClFN3O4S MolecularWeight: 518.000103

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=C(C=C1)F)CC2=CC=CS2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=C(C=C1)F)CC2=CC=CS2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H25ClFN3O4S/c1-3-17(2)29(25(32)19-8-11-22(26)23(13-19)30(33)34)16-24(31)28(15-21-5-4-12-35-21)14-18-6-9-20(27)10-7-18/h4-13,17H,3,14-16H2,1-2H3