2-[2-[(1-adamantylcarbonylamino)carbamoyl]phenyl]sulfanyl-N-cyclopropyl-ethanamide

Systemtic Name: 2-[2-[(1-adamantylcarbonylamino)carbamoyl]phenyl]sulfanyl-N-cyclopropyl-ethanamide Openeye Name: 2-[2-[(adamantane-1-carbonylamino)carbamoyl]phenyl]sulfanyl-N-cyclopropyl-acetamide CAS Name: 2-[[2-[[[1-adamantyl(oxo)methyl]hydrazo]-oxomethyl]phenyl]thio]-N-cyclopropylacetamide IUPAC Name: 2-[2-[(adamantane-1-carbonylamino)carbamoyl]phenyl]sulfanyl-N-cyclopropylacetamide Traditional Name: 2-[[2-[(adamantane-1-carbonylamino)carbamoyl]phenyl]thio]-N-cyclopropyl-acetamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CSC2=CC=CC=C2C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC1NC(=O)CSC2=CC=CC=C2C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N3O3S/c27-20(24-17-5-6-17)13-30-19-4-2-1-3-18(19)21(28)25-26-22(29)23-10-14-7-15(11-23)9-16(8-14)12-23/h1-4,14-17H,5-13H2,(H,24,27)(H,25,28)(H,26,29)