N-[3-[(2-cyclopentylsulfanylphenyl)amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide

Systemtic Name: N-[3-[(2-cyclopentylsulfanylphenyl)amino]-3-oxidanylidene-propyl]adamantane-1-carboxamide Openeye Name: N-[3-(2-cyclopentylsulfanylanilino)-3-oxo-propyl]adamantane-1-carboxamide CAS Name: N-[3-[2-(cyclopentylthio)anilino]-3-oxopropyl]-1-adamantanecarboxamide IUPAC Name: N-[3-(2-cyclopentylsulfanylanilino)-3-oxopropyl]adamantane-1-carboxamide Traditional Name: N-[3-[2-(cyclopentylthio)anilino]-3-keto-propyl]adamantane-1-carboxamide Formula: C25H34N2O2S MolecularWeight: 426.61466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SC2=CC=CC=C2NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCC(C1)SC2=CC=CC=C2NC(=O)CCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N2O2S/c28-23(27-21-7-3-4-8-22(21)30-20-5-1-2-6-20)9-10-26-24(29)25-14-17-11-18(15-25)13-19(12-17)16-25/h3-4,7-8,17-20H,1-2,5-6,9-16H2,(H,26,29)(H,27,28)