4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[3-(phenylmethyl)-1,3-thiazol-2-ylidene]butanamide

Systemtic Name: 4-[(4-fluorophenyl)sulfonyl-methyl-amino]-N-[3-(phenylmethyl)-1,3-thiazol-2-ylidene]butanamide Openeye Name: N-(3-benzylthiazol-2-ylidene)-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butanamide CAS Name: 4-[(4-fluorophenyl)sulfonyl-methylamino]-N-[3-(phenylmethyl)-2-thiazolylidene]butanamide IUPAC Name: N-(3-benzyl-1,3-thiazol-2-ylidene)-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide Traditional Name: N-(3-benzyl-4-thiazolin-2-ylidene)-4-[(4-fluorophenyl)sulfonyl-methyl-amino]butyramide Formula: C21H22FN3O3S2 MolecularWeight: 447.546083

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)N=C1N(C=CS1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CN(CCCC(=O)N=C1N(C=CS1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H22FN3O3S2/c1-24(30(27,28)19-11-9-18(22)10-12-19)13-5-8-20(26)23-21-25(14-15-29-21)16-17-6-3-2-4-7-17/h2-4,6-7,9-12,14-15H,5,8,13,16H2,1H3