4-(3-methylpiperidin-1-yl)sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide

Systemtic Name: 4-(3-methylpiperidin-1-yl)sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Openeye Name: 4-[(3-methyl-1-piperidyl)sulfonyl]-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide CAS Name: 4-[(3-methyl-1-piperidinyl)sulfonyl]-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide IUPAC Name: 4-(3-methylpiperidin-1-yl)sulfonyl-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzamide Traditional Name: 4-(3-methylpiperidino)sulfonyl-N-(3-propargyl-1,3-benzothiazol-2-ylidene)benzamide Formula: C23H23N3O3S2 MolecularWeight: 453.57702

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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=CC=CC=C4S3)CC#C

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=CC=CC=C4S3)CC#C

InChI

InChI=1S/C23H23N3O3S2/c1-3-14-26-20-8-4-5-9-21(20)30-23(26)24-22(27)18-10-12-19(13-11-18)31(28,29)25-15-6-7-17(2)16-25/h1,4-5,8-13,17H,6-7,14-16H2,2H3