N-[4-oxidanylidene-4-[(2-prop-2-enylsulfanylphenyl)amino]butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[(2-prop-2-enylsulfanylphenyl)amino]butyl]adamantane-1-carboxamide Openeye Name: N-[4-(2-allylsulfanylanilino)-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-oxo-4-[2-(prop-2-enylthio)anilino]butyl]-1-adamantanecarboxamide IUPAC Name: N-[4-oxo-4-(2-prop-2-enylsulfanylanilino)butyl]adamantane-1-carboxamide Traditional Name: N-[4-[2-(allylthio)anilino]-4-keto-butyl]adamantane-1-carboxamide Formula: C24H32N2O2S MolecularWeight: 412.58808

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)CCCNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H32N2O2S/c1-2-10-29-21-7-4-3-6-20(21)26-22(27)8-5-9-25-23(28)24-14-17-11-18(15-24)13-19(12-17)16-24/h2-4,6-7,17-19H,1,5,8-16H2,(H,25,28)(H,26,27)