N-[(4-ethylphenyl)methyl]-8-methyl-1-propanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: N-[(4-ethylphenyl)methyl]-8-methyl-1-propanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: N-[(4-ethylphenyl)methyl]-8-methyl-1-propanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: N-[(4-ethylphenyl)methyl]-8-methyl-1-(1-oxopropyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: N-[(4-ethylphenyl)methyl]-8-methyl-1-propanoyl-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: N-(4-ethylbenzyl)-8-methyl-1-propionyl-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:

CCC1=CC=C(C=C1)CNC(=O)C2CSC3(N2C(=O)CC)CCN(CC3)C

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)C2CSC3(N2C(=O)CC)CCN(CC3)C

InChI

InChI=1S/C21H31N3O2S/c1-4-16-6-8-17(9-7-16)14-22-20(26)18-15-27-21(24(18)19(25)5-2)10-12-23(3)13-11-21/h6-9,18H,4-5,10-15H2,1-3H3,(H,22,26)