N-[4-[(1-adamantylcarbonylamino)carbamoyl]phenyl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[(1-adamantylcarbonylamino)carbamoyl]phenyl]-2-(1-methylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-[4-[(adamantane-1-carbonylamino)carbamoyl]phenyl]-2-(1-methylimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[4-[[[1-adamantyl(oxo)methyl]hydrazo]-oxomethyl]phenyl]-2-[(1-methyl-2-imidazolyl)thio]acetamide IUPAC Name: N-[4-[(adamantane-1-carbonylamino)carbamoyl]phenyl]-2-(1-methylimidazol-2-yl)sulfanylacetamide Traditional Name: N-[4-[(adamantane-1-carbonylamino)carbamoyl]phenyl]-2-[(1-methylimidazol-2-yl)thio]acetamide Formula: C24H29N5O3S MolecularWeight: 467.58376

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H29N5O3S/c1-29-7-6-25-23(29)33-14-20(30)26-19-4-2-18(3-5-19)21(31)27-28-22(32)24-11-15-8-16(12-24)10-17(9-15)13-24/h2-7,15-17H,8-14H2,1H3,(H,26,30)(H,27,31)(H,28,32)