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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=CC5=CC=CC=C54)C

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=CC5=CC=CC=C54)C

InChI

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