[2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl]-[(5-chloranylthiophen-2-yl)methyl]-methyl-azanium

Systemtic Name: [2-(1-adamantylcarbamoylamino)-2-oxidanylidene-ethyl]-[(5-chloranylthiophen-2-yl)methyl]-methyl-azanium Openeye Name: [2-(1-adamantylcarbamoylamino)-2-oxo-ethyl]-[(5-chloro-2-thienyl)methyl]-methyl-ammonium CAS Name: [2-[[(1-adamantylamino)-oxomethyl]amino]-2-oxoethyl]-[(5-chloro-2-thiophenyl)methyl]-methylammonium IUPAC Name: [2-(1-adamantylcarbamoylamino)-2-oxoethyl]-[(5-chlorothiophen-2-yl)methyl]-methylazanium Traditional Name: [2-(1-adamantylcarbamoylamino)-2-keto-ethyl]-[(5-chloro-2-thienyl)methyl]-methyl-ammonium Formula: C19H27ClN3O2S+ MolecularWeight: 396.95458

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(S1)Cl)CC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[NH+](CC1=CC=C(S1)Cl)CC(=O)NC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H26ClN3O2S/c1-23(10-15-2-3-16(20)26-15)11-17(24)21-18(25)22-19-7-12-4-13(8-19)6-14(5-12)9-19/h2-3,12-14H,4-11H2,1H3,(H2,21,22,24,25)/p+1