N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-(4-chlorophenyl)sulfanyl-butanamide

Systemtic Name: N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-(4-chlorophenyl)sulfanyl-butanamide Openeye Name: N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-(4-chlorophenyl)sulfanyl-butanamide CAS Name: N-[2-[(2-chlorophenyl)methyl]-3-pyrazolyl]-4-[(4-chlorophenyl)thio]butanamide IUPAC Name: N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-4-(4-chlorophenyl)sulfanylbutanamide Traditional Name: N-[2-(2-chlorobenzyl)pyrazol-3-yl]-4-[(4-chlorophenyl)thio]butyramide Formula: C20H19Cl2N3OS MolecularWeight: 420.35536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=CC=N2)NC(=O)CCCSC3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=CC=N2)NC(=O)CCCSC3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H19Cl2N3OS/c21-16-7-9-17(10-8-16)27-13-3-6-20(26)24-19-11-12-23-25(19)14-15-4-1-2-5-18(15)22/h1-2,4-5,7-12H,3,6,13-14H2,(H,24,26)