3-(4-methylphenyl)sulfonyl-N-(3-propyl-1,3-benzothiazol-2-ylidene)propanamide

Systemtic Name: 3-(4-methylphenyl)sulfonyl-N-(3-propyl-1,3-benzothiazol-2-ylidene)propanamide Openeye Name: N-(3-propyl-1,3-benzothiazol-2-ylidene)-3-(p-tolylsulfonyl)propanamide CAS Name: 3-(4-methylphenyl)sulfonyl-N-(3-propyl-1,3-benzothiazol-2-ylidene)propanamide IUPAC Name: 3-(4-methylphenyl)sulfonyl-N-(3-propyl-1,3-benzothiazol-2-ylidene)propanamide Traditional Name: N-(3-propyl-1,3-benzothiazol-2-ylidene)-3-tosyl-propionamide Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCN1C2=CC=CC=C2SC1=NC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H22N2O3S2/c1-3-13-22-17-6-4-5-7-18(17)26-20(22)21-19(23)12-14-27(24,25)16-10-8-15(2)9-11-16/h4-11H,3,12-14H2,1-2H3