N-[3-[1-[(2-bromophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[1-[(2-bromophenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanylphenyl]thiophene-2-carboxamide Openeye Name: N-[3-[1-[(2-bromophenyl)carbamoyl]propylsulfanyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[1-(2-bromoanilino)-1-oxobutan-2-yl]thio]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[1-(2-bromoanilino)-1-oxobutan-2-yl]sulfanylphenyl]thiophene-2-carboxamide Traditional Name: N-[3-[1-[(2-bromophenyl)carbamoyl]propylthio]phenyl]thiophene-2-carboxamide Formula: C21H19BrN2O2S2 MolecularWeight: 475.42176

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1Br)SC2=CC=CC(=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1Br)SC2=CC=CC(=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H19BrN2O2S2/c1-2-18(20(25)24-17-10-4-3-9-16(17)22)28-15-8-5-7-14(13-15)23-21(26)19-11-6-12-27-19/h3-13,18H,2H2,1H3,(H,23,26)(H,24,25)