3-(2-formamido-4-methylsulfanyl-butanoyl)-N-(2-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carboxamide

Systemtic Name: 3-(2-formamido-4-methylsulfanyl-butanoyl)-N-(2-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carboxamide Openeye Name: 3-(2-formamido-4-methylsulfanyl-butanoyl)-N-(2-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carboxamide CAS Name: 3-[2-formamido-4-(methylthio)-1-oxobutyl]-N-(2-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carboxamide IUPAC Name: 3-(2-formamido-4-methylsulfanylbutanoyl)-N-(2-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carboxamide Traditional Name: 3-[2-formamido-4-(methylthio)butanoyl]-N-(2-methoxyphenyl)-3,8-diazaspiro[4.5]decane-8-carboxamide Formula: C22H32N4O4S MolecularWeight: 448.57888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)N2CCC3(CC2)CCN(C3)C(=O)C(CCSC)NC=O

Isomeric SMILES

COC1=CC=CC=C1NC(=O)N2CCC3(CC2)CCN(C3)C(=O)C(CCSC)NC=O

InChI

InChI=1S/C22H32N4O4S/c1-30-19-6-4-3-5-17(19)24-21(29)25-11-8-22(9-12-25)10-13-26(15-22)20(28)18(23-16-27)7-14-31-2/h3-6,16,18H,7-15H2,1-2H3,(H,23,27)(H,24,29)