N-[1-(4-butan-2-ylphenyl)propyl]-3-chloranyl-4-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)propyl]-3-chloranyl-4-methyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-4-methyl-N-[1-(4-sec-butylphenyl)propyl]benzothiophene-2-carboxamide CAS Name: N-[1-(4-butan-2-ylphenyl)propyl]-3-chloro-4-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)propyl]-3-chloro-4-methyl-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-4-methyl-N-[1-(4-sec-butylphenyl)propyl]benzothiophene-2-carboxamide Formula: C23H26ClNOS MolecularWeight: 399.97664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=C(C3=C(C=CC=C3S2)C)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(CC)NC(=O)C2=C(C3=C(C=CC=C3S2)C)Cl

InChI

InChI=1S/C23H26ClNOS/c1-5-14(3)16-10-12-17(13-11-16)18(6-2)25-23(26)22-21(24)20-15(4)8-7-9-19(20)27-22/h7-14,18H,5-6H2,1-4H3,(H,25,26)