1-[8-(4-ethylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[8-(4-ethylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[8-(4-ethylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-butan-1-one CAS Name: 1-[8-[(4-ethylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-1-butanone IUPAC Name: 1-[8-(4-ethylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methylbutan-1-one Traditional Name: 1-[8-(4-ethylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-3-methyl-butan-1-one Formula: C21H30N2O2S MolecularWeight: 374.5401

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)CC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCC3(CC2)N(CCS3)C(=O)CC(C)C

InChI

InChI=1S/C21H30N2O2S/c1-4-17-5-7-18(8-6-17)20(25)22-11-9-21(10-12-22)23(13-14-26-21)19(24)15-16(2)3/h5-8,16H,4,9-15H2,1-3H3