N-[3-methyl-1-[2-[2-(4-methylphenyl)sulfanylethanoyl]hydrazinyl]-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[3-methyl-1-[2-[2-(4-methylphenyl)sulfanylethanoyl]hydrazinyl]-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[2-methyl-1-[[[2-(p-tolylsulfanyl)acetyl]amino]carbamoyl]propyl]adamantane-1-carboxamide CAS Name: N-[3-methyl-1-[[2-[(4-methylphenyl)thio]-1-oxoethyl]hydrazo]-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[3-methyl-1-[2-[2-(4-methylphenyl)sulfanylacetyl]hydrazinyl]-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[2-methyl-1-[[[2-(p-tolylthio)acetyl]amino]carbamoyl]propyl]adamantane-1-carboxamide Formula: C25H35N3O3S MolecularWeight: 457.6287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NNC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NNC(=O)C(C(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H35N3O3S/c1-15(2)22(23(30)28-27-21(29)14-32-20-6-4-16(3)5-7-20)26-24(31)25-11-17-8-18(12-25)10-19(9-17)13-25/h4-7,15,17-19,22H,8-14H2,1-3H3,(H,26,31)(H,27,29)(H,28,30)