3-(4-chlorophenyl)sulfanyl-N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-(6-isopropyl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-(6-propan-2-yl-3-propyl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-(6-isopropyl-3-propyl-1,3-benzothiazol-2-ylidene)propionamide Formula: C22H25ClN2OS2 MolecularWeight: 433.0297

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2OS2/c1-4-12-25-19-10-5-16(15(2)3)14-20(19)28-22(25)24-21(26)11-13-27-18-8-6-17(23)7-9-18/h5-10,14-15H,4,11-13H2,1-3H3