N-(6-bromanyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(6-bromanyl-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-(6-bromo-3-methyl-1,3-benzothiazol-2-ylidene)-4-(4-methylpiperidino)sulfonyl-benzamide Formula: C21H22BrN3O3S2 MolecularWeight: 508.45168

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)Br)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)Br)C

InChI

InChI=1S/C21H22BrN3O3S2/c1-14-9-11-25(12-10-14)30(27,28)17-6-3-15(4-7-17)20(26)23-21-24(2)18-8-5-16(22)13-19(18)29-21/h3-8,13-14H,9-12H2,1-2H3