ethyl 4-[[1-(3-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[1-(3-methylphenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-8-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[1-(3-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(3-methylphenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-8-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[1-(3-methylbenzoyl)-4-thia-1,8-diazaspiro[4.5]decane-8-carbonyl]amino]benzoate Traditional Name: 4-[(1-m-toluoyl-4-thia-1,8-diazaspiro[4.5]decane-8-carbonyl)amino]benzoic acid ethyl ester Formula: C25H29N3O4S MolecularWeight: 467.58046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCC3(CC2)N(CCS3)C(=O)C4=CC(=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCC3(CC2)N(CCS3)C(=O)C4=CC(=CC=C4)C

InChI

InChI=1S/C25H29N3O4S/c1-3-32-23(30)19-7-9-21(10-8-19)26-24(31)27-13-11-25(12-14-27)28(15-16-33-25)22(29)20-6-4-5-18(2)17-20/h4-10,17H,3,11-16H2,1-2H3,(H,26,31)