1-[3-[[8-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]phenyl]thiourea

Systemtic Name: 1-[3-[[8-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]-3,8-diazaspiro[4.5]decan-3-yl]carbonyl]phenyl]thiourea Openeye Name: [3-[8-(3,5-dimethylisoxazole-4-carbonyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]phenyl]thiourea CAS Name: [3-[[8-[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]-3,8-diazaspiro[4.5]decan-3-yl]-oxomethyl]phenyl]thiourea IUPAC Name: [3-[8-(3,5-dimethyl-1,2-oxazole-4-carbonyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]phenyl]thiourea Traditional Name: [3-[8-(3,5-dimethylisoxazole-4-carbonyl)-3,8-diazaspiro[4.5]decane-3-carbonyl]phenyl]thiourea Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CCC3(CC2)CCN(C3)C(=O)C4=CC(=CC=C4)NC(=S)N

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CCC3(CC2)CCN(C3)C(=O)C4=CC(=CC=C4)NC(=S)N

InChI

InChI=1S/C22H27N5O3S/c1-14-18(15(2)30-25-14)20(29)26-9-6-22(7-10-26)8-11-27(13-22)19(28)16-4-3-5-17(12-16)24-21(23)31/h3-5,12H,6-11,13H2,1-2H3,(H3,23,24,31)