2-(2-morpholin-4-ium-4-ylethylcarbamoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-(2-morpholin-4-ium-4-ylethylcarbamoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-(2-morpholin-4-ium-4-ylethylcarbamoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[[2-(4-morpholin-4-iumyl)ethylamino]-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-(2-morpholin-4-ium-4-ylethylcarbamoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-(2-morpholin-4-ium-4-ylethylcarbamoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C16H25N4O3S+ MolecularWeight: 353.4597

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)NCC[NH+]3CCOCC3)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)NCC[NH+]3CCOCC3)C(=O)N

InChI

InChI=1S/C16H24N4O3S/c17-14(21)13-11-3-1-2-4-12(11)24-15(13)19-16(22)18-5-6-20-7-9-23-10-8-20/h1-10H2,(H2,17,21)(H2,18,19,22)/p+1