N-[5-[(3-bromophenyl)methyl-cyclopropyl-carbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[5-[(3-bromophenyl)methyl-cyclopropyl-carbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-[(3-bromophenyl)methyl-cyclopropyl-carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[5-[[(3-bromophenyl)methyl-cyclopropylamino]-oxomethyl]-2-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-[(3-bromophenyl)methyl-cyclopropylcarbamoyl]-2-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[5-[(3-bromobenzyl)-cyclopropyl-carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide Formula: C22H18BrClN2O2S MolecularWeight: 489.81252

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC(=CC=C2)Br)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CC1N(CC2=CC(=CC=C2)Br)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H18BrClN2O2S/c23-16-4-1-3-14(11-16)13-26(17-7-8-17)22(28)15-6-9-18(24)19(12-15)25-21(27)20-5-2-10-29-20/h1-6,9-12,17H,7-8,13H2,(H,25,27)