N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(1-methyl-2-benzo[e][1,3]benzothiazolylidene)-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(1-methylbenzo[e][1,3]benzothiazol-2-ylidene)-4-(3-methylpiperidino)sulfonyl-benzamide Formula: C25H25N3O3S2 MolecularWeight: 479.6143

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=CC5=CC=CC=C54)C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=CC5=CC=CC=C54)C

InChI

InChI=1S/C25H25N3O3S2/c1-17-6-5-15-28(16-17)33(30,31)20-12-9-19(10-13-20)24(29)26-25-27(2)23-21-8-4-3-7-18(21)11-14-22(23)32-25/h3-4,7-14,17H,5-6,15-16H2,1-2H3