N-(1-adamantylcarbamoyl)-2-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[(5-chloranylthiophen-2-yl)methyl-methyl-amino]propanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[(5-chloro-2-thienyl)methyl-methyl-amino]propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[(5-chloro-2-thiophenyl)methyl-methylamino]propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[(5-chlorothiophen-2-yl)methyl-methylamino]propanamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[(5-chloro-2-thienyl)methyl-methyl-amino]propionamide Formula: C20H28ClN3O2S MolecularWeight: 409.97322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)N(C)CC4=CC=C(S4)Cl

Isomeric SMILES

CC(C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2)N(C)CC4=CC=C(S4)Cl

InChI

InChI=1S/C20H28ClN3O2S/c1-12(24(2)11-16-3-4-17(21)27-16)18(25)22-19(26)23-20-8-13-5-14(9-20)7-15(6-13)10-20/h3-4,12-15H,5-11H2,1-2H3,(H2,22,23,25,26)