4-(3-butylthiophen-2-yl)-2-[(3-chlorophenyl)methyl]-5-(methylamino)thiophen-3-one

Systemtic Name: 4-(3-butylthiophen-2-yl)-2-[(3-chlorophenyl)methyl]-5-(methylamino)thiophen-3-one Openeye Name: 4-(3-butyl-2-thienyl)-2-[(3-chlorophenyl)methyl]-5-(methylamino)thiophen-3-one CAS Name: 4-(3-butyl-2-thiophenyl)-2-[(3-chlorophenyl)methyl]-5-(methylamino)-3-thiophenone IUPAC Name: 4-(3-butylthiophen-2-yl)-2-[(3-chlorophenyl)methyl]-5-(methylamino)thiophen-3-one Traditional Name: 4-(3-butyl-2-thienyl)-2-(3-chlorobenzyl)-5-(methylamino)thiophen-3-one Formula: C20H22ClNOS2 MolecularWeight: 391.97778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(SC=C1)C2=C(SC(C2=O)CC3=CC(=CC=C3)Cl)NC

Isomeric SMILES

CCCCC1=C(SC=C1)C2=C(SC(C2=O)CC3=CC(=CC=C3)Cl)NC

InChI

InChI=1S/C20H22ClNOS2/c1-3-4-7-14-9-10-24-19(14)17-18(23)16(25-20(17)22-2)12-13-6-5-8-15(21)11-13/h5-6,8-11,16,22H,3-4,7,12H2,1-2H3