N-(1-adamantylcarbamoyl)-2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-(1-adamantylcarbamoyl)-2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-(1-adamantylcarbamoyl)-2-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]propanamide CAS Name: N-[(1-adamantylamino)-oxomethyl]-2-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]propanamide IUPAC Name: N-(1-adamantylcarbamoyl)-2-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-(1-adamantylcarbamoyl)-2-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]propionamide Formula: C23H34N4O4S2 MolecularWeight: 494.67046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H34N4O4S2/c1-15-3-4-20(32-15)33(30,31)27-7-5-26(6-8-27)16(2)21(28)24-22(29)25-23-12-17-9-18(13-23)11-19(10-17)14-23/h3-4,16-19H,5-14H2,1-2H3,(H2,24,25,28,29)