4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]-N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]butanamide

Systemtic Name: 4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]-N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]butanamide Openeye Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]butanamide CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]butanamide IUPAC Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]butanamide Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[(Z)-(3-methyl-1,3-benzothiazol-2-ylidene)amino]butyramide Formula: C21H24N4O4S2 MolecularWeight: 460.56966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)NN=C2N(C3=CC=CC=C3S2)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)N/N=C\2/N(C3=CC=CC=C3S2)C

InChI

InChI=1S/C21H24N4O4S2/c1-15(26)16-10-12-17(13-11-16)31(28,29)24(2)14-6-9-20(27)22-23-21-25(3)18-7-4-5-8-19(18)30-21/h4-5,7-8,10-13H,6,9,14H2,1-3H3,(H,22,27)/b23-21-