3-methyl-N-[(5S)-5-(4-morpholin-4-ium-4-ylpiperidin-1-yl)carbonyl-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]benzamide

Systemtic Name: 3-methyl-N-[(5S)-5-(4-morpholin-4-ium-4-ylpiperidin-1-yl)carbonyl-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]benzamide Openeye Name: 3-methyl-N-[(5S)-5-(4-morpholin-4-ium-4-ylpiperidine-1-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]benzamide CAS Name: 3-methyl-N-[(5S)-5-[[4-(4-morpholin-4-iumyl)-1-piperidinyl]-oxomethyl]-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 3-methyl-N-[(5S)-5-(4-morpholin-4-ium-4-ylpiperidine-1-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]benzamide Traditional Name: N-[(5S)-7-keto-5-(4-morpholin-4-ium-4-ylpiperidine-1-carbonyl)-5,6-dihydro-4H-1,3-benzothiazol-2-yl]-3-methyl-benzamide Formula: C25H31N4O4S+ MolecularWeight: 483.60304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C(=O)CC(C3)C(=O)N4CCC(CC4)[NH+]5CCOCC5

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=NC3=C(S2)C(=O)C[C@H](C3)C(=O)N4CCC(CC4)[NH+]5CCOCC5

InChI

InChI=1S/C25H30N4O4S/c1-16-3-2-4-17(13-16)23(31)27-25-26-20-14-18(15-21(30)22(20)34-25)24(32)29-7-5-19(6-8-29)28-9-11-33-12-10-28/h2-4,13,18-19H,5-12,14-15H2,1H3,(H,26,27,31)/p+1/t18-/m0/s1