N-[3-methyl-1-[(4-methylsulfanylphenyl)amino]-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[3-methyl-1-[(4-methylsulfanylphenyl)amino]-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[2-methyl-1-[(4-methylsulfanylphenyl)carbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[3-methyl-1-[4-(methylthio)anilino]-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[3-methyl-1-(4-methylsulfanylanilino)-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-methyl-1-[[4-(methylthio)phenyl]carbamoyl]propyl]adamantane-1-carboxamide Formula: C23H32N2O2S MolecularWeight: 400.57738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)SC)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)SC)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H32N2O2S/c1-14(2)20(21(26)24-18-4-6-19(28-3)7-5-18)25-22(27)23-11-15-8-16(12-23)10-17(9-15)13-23/h4-7,14-17,20H,8-13H2,1-3H3,(H,24,26)(H,25,27)