2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[(cyclohexylamino)methylidene]pyrazol-3-one

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[(cyclohexylamino)methylidene]pyrazol-3-one Openeye Name: 2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[(cyclohexylamino)methylene]pyrazol-3-one CAS Name: 2-(1,3-benzothiazol-2-yl)-5-[[(4-chlorophenyl)thio]methyl]-4-[(cyclohexylamino)methylidene]-3-pyrazolone IUPAC Name: 2-(1,3-benzothiazol-2-yl)-5-[(4-chlorophenyl)sulfanylmethyl]-4-[(cyclohexylamino)methylidene]pyrazol-3-one Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-[[(4-chlorophenyl)thio]methyl]-4-[(cyclohexylamino)methylene]-2-pyrazolin-3-one Formula: C24H23ClN4OS2 MolecularWeight: 483.04862

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)CSC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCC(CC1)NC=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)CSC5=CC=C(C=C5)Cl

InChI

InChI=1S/C24H23ClN4OS2/c25-16-10-12-18(13-11-16)31-15-21-19(14-26-17-6-2-1-3-7-17)23(30)29(28-21)24-27-20-8-4-5-9-22(20)32-24/h4-5,8-14,17,26H,1-3,6-7,15H2