N-[4-chloranyl-2-[[(E)-thiophen-2-ylmethylideneamino]carbamoyl]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-chloranyl-2-[[(E)-thiophen-2-ylmethylideneamino]carbamoyl]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-chloro-2-[[(E)-2-thienylmethyleneamino]carbamoyl]phenyl]adamantane-1-carboxamide CAS Name: N-[4-chloro-2-[oxo-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]methyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-chloro-2-[[(E)-thiophen-2-ylmethylideneamino]carbamoyl]phenyl]adamantane-1-carboxamide Traditional Name: N-[4-chloro-2-[[(E)-2-thenylideneamino]carbamoyl]phenyl]adamantane-1-carboxamide Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C(C=C(C=C4)Cl)C(=O)NN=CC5=CC=CS5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=C(C=C(C=C4)Cl)C(=O)N/N=C/C5=CC=CS5

InChI

InChI=1S/C23H24ClN3O2S/c24-17-3-4-20(19(9-17)21(28)27-25-13-18-2-1-5-30-18)26-22(29)23-10-14-6-15(11-23)8-16(7-14)12-23/h1-5,9,13-16H,6-8,10-12H2,(H,26,29)(H,27,28)/b25-13+