2-(4-chlorophenyl)sulfanyl-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]butanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[(3-methoxy-4-propan-2-yloxy-phenyl)methyl]butanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[(4-isopropoxy-3-methoxy-phenyl)methyl]butanamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]butanamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[(3-methoxy-4-propan-2-yloxyphenyl)methyl]butanamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-(4-isopropoxy-3-methoxy-benzyl)butyramide Formula: C21H26ClNO3S MolecularWeight: 407.95404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC(=C(C=C1)OC(C)C)OC)SC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C(=O)NCC1=CC(=C(C=C1)OC(C)C)OC)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H26ClNO3S/c1-5-20(27-17-9-7-16(22)8-10-17)21(24)23-13-15-6-11-18(26-14(2)3)19(12-15)25-4/h6-12,14,20H,5,13H2,1-4H3,(H,23,24)