1-methylsulfonyl-N-[3-(phenylmethyl)-1,3-thiazol-2-ylidene]-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: 1-methylsulfonyl-N-[3-(phenylmethyl)-1,3-thiazol-2-ylidene]-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-(3-benzylthiazol-2-ylidene)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: 1-methylsulfonyl-N-[3-(phenylmethyl)-2-thiazolylidene]-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-(3-benzyl-1,3-thiazol-2-ylidene)-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-(3-benzyl-4-thiazolin-2-ylidene)-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)N=C3N(C=CS3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)N=C3N(C=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3S2/c1-29(26,27)24-11-5-8-17-14-18(9-10-19(17)24)20(25)22-21-23(12-13-28-21)15-16-6-3-2-4-7-16/h2-4,6-7,9-10,12-14H,5,8,11,15H2,1H3