4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-[(3,5-dimethyl-1-piperidyl)sulfonyl]-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(6-ethoxy-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-(3,5-dimethylpiperidino)sulfonyl-N-(6-ethoxy-3-propargyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C26H29N3O4S2 MolecularWeight: 511.65616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(CC(C4)C)C)S2)CC#C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(CC(C4)C)C)S2)CC#C

InChI

InChI=1S/C26H29N3O4S2/c1-5-13-29-23-12-9-21(33-6-2)15-24(23)34-26(29)27-25(30)20-7-10-22(11-8-20)35(31,32)28-16-18(3)14-19(4)17-28/h1,7-12,15,18-19H,6,13-14,16-17H2,2-4H3