N-[4-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: N-[4-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxidanylidene-propyl]-1,3-thiazol-2-yl]benzamide Openeye Name: N-[4-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxo-propyl]thiazol-2-yl]benzamide CAS Name: N-[4-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]-2-thiazolyl]benzamide IUPAC Name: N-[4-[3-[(6-methylsulfonyl-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]-1,3-thiazol-2-yl]benzamide Traditional Name: N-[4-[3-keto-3-[(6-mesyl-1,3-benzothiazol-2-yl)amino]propyl]thiazol-2-yl]benzamide Formula: C21H18N4O4S3 MolecularWeight: 486.58702

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CSC(=N3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3=CSC(=N3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O4S3/c1-32(28,29)15-8-9-16-17(11-15)31-21(23-16)24-18(26)10-7-14-12-30-20(22-14)25-19(27)13-5-3-2-4-6-13/h2-6,8-9,11-12H,7,10H2,1H3,(H,22,25,27)(H,23,24,26)