N-[3-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)carbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)carbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)carbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[[2-methyl-2-(4-morpholin-4-iumyl)propyl]amino]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[(2-methyl-2-morpholin-4-ium-4-ylpropyl)carbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)carbamoyl]phenyl]thiophene-2-carboxamide Formula: C20H26N3O3S+ MolecularWeight: 388.50374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=CS2)[NH+]3CCOCC3

Isomeric SMILES

CC(C)(CNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=CS2)[NH+]3CCOCC3

InChI

InChI=1S/C20H25N3O3S/c1-20(2,23-8-10-26-11-9-23)14-21-18(24)15-5-3-6-16(13-15)22-19(25)17-7-4-12-27-17/h3-7,12-13H,8-11,14H2,1-2H3,(H,21,24)(H,22,25)/p+1