N-[5-[(4-acetamidophenyl)methylcarbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[5-[(4-acetamidophenyl)methylcarbamoyl]-2-chloranyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[5-[(4-acetamidophenyl)methylcarbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[5-[[(4-acetamidophenyl)methylamino]-oxomethyl]-2-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[5-[(4-acetamidophenyl)methylcarbamoyl]-2-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[5-[(4-acetamidobenzyl)carbamoyl]-2-chloro-phenyl]thiophene-2-carboxamide Formula: C21H18ClN3O3S MolecularWeight: 427.90392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H18ClN3O3S/c1-13(26)24-16-7-4-14(5-8-16)12-23-20(27)15-6-9-17(22)18(11-15)25-21(28)19-3-2-10-29-19/h2-11H,12H2,1H3,(H,23,27)(H,24,26)(H,25,28)