8-(3-methylbutanoyl)-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: 8-(3-methylbutanoyl)-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: 8-(3-methylbutanoyl)-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: 8-(3-methyl-1-oxobutyl)-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: 8-(3-methylbutanoyl)-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: 8-isovaleryl-N-phenethyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC2(CC1)NC(CS2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)N1CCC2(CC1)NC(CS2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C21H31N3O2S/c1-16(2)14-19(25)24-12-9-21(10-13-24)23-18(15-27-21)20(26)22-11-8-17-6-4-3-5-7-17/h3-7,16,18,23H,8-15H2,1-2H3,(H,22,26)