diethyl-[2-[ethyl-(2-thiomorpholin-4-yl-6-thiophen-2-yl-pyridin-3-yl)carbonyl-amino]ethyl]azanium

Systemtic Name: diethyl-[2-[ethyl-(2-thiomorpholin-4-yl-6-thiophen-2-yl-pyridin-3-yl)carbonyl-amino]ethyl]azanium Openeye Name: diethyl-[2-[ethyl-[6-(2-thienyl)-2-thiomorpholino-pyridine-3-carbonyl]amino]ethyl]ammonium CAS Name: diethyl-[2-[ethyl-[oxo-(2-thiomorpholin-4-yl-6-thiophen-2-yl-3-pyridinyl)methyl]amino]ethyl]ammonium IUPAC Name: diethyl-[2-[ethyl-(2-thiomorpholin-4-yl-6-thiophen-2-ylpyridine-3-carbonyl)amino]ethyl]azanium Traditional Name: diethyl-[2-[ethyl-[6-(2-thienyl)-2-thiomorpholino-nicotinoyl]amino]ethyl]ammonium Formula: C22H33N4OS2+ MolecularWeight: 433.65362

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN(CC)C(=O)C1=C(N=C(C=C1)C2=CC=CS2)N3CCSCC3

Isomeric SMILES

CC[NH+](CC)CCN(CC)C(=O)C1=C(N=C(C=C1)C2=CC=CS2)N3CCSCC3

InChI

InChI=1S/C22H32N4OS2/c1-4-24(5-2)11-12-25(6-3)22(27)18-9-10-19(20-8-7-15-29-20)23-21(18)26-13-16-28-17-14-26/h7-10,15H,4-6,11-14,16-17H2,1-3H3/p+1