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

Systemtic Name: N-[3-(2-ethoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[3-(2-ethoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-4-[(3-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[3-(2-ethoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[3-(2-ethoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-4-(3-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[3-(2-ethoxyethyl)-6-methyl-1,3-benzothiazol-2-ylidene]-4-(3-methylpiperidino)sulfonyl-benzamide Formula: C25H31N3O4S2 MolecularWeight: 501.66134

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(C=C(C=C2)C)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC(C4)C

Isomeric SMILES

CCOCCN1C2=C(C=C(C=C2)C)SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC(C4)C

InChI

InChI=1S/C25H31N3O4S2/c1-4-32-15-14-28-22-12-7-18(2)16-23(22)33-25(28)26-24(29)20-8-10-21(11-9-20)34(30,31)27-13-5-6-19(3)17-27/h7-12,16,19H,4-6,13-15,17H2,1-3H3