4-[(4-ethylphenyl)sulfonylamino]-2,2-dimethyl-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-3-oxidanyl-3,4-dihydrochromene-6-carboxamide

Systemtic Name: 4-[(4-ethylphenyl)sulfonylamino]-2,2-dimethyl-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-3-oxidanyl-3,4-dihydrochromene-6-carboxamide Openeye Name: 4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)chromane-6-carboxamide CAS Name: 4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]-3,4-dihydro-2H-1-benzopyran-6-carboxamide IUPAC Name: 4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)-3,4-dihydrochromene-6-carboxamide Traditional Name: 4-[(4-ethylphenyl)sulfonylamino]-3-hydroxy-2,2-dimethyl-N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]chroman-6-carboxamide Formula: C23H27N5O5S2 MolecularWeight: 517.62098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)NC2C(C(OC3=C2C=C(C=C3)C(=O)NC4=NC(=NN4)SC)(C)C)O

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)NC2C(C(OC3=C2C=C(C=C3)C(=O)NC4=NC(=NN4)SC)(C)C)O

InChI

InChI=1S/C23H27N5O5S2/c1-5-13-6-9-15(10-7-13)35(31,32)28-18-16-12-14(8-11-17(16)33-23(2,3)19(18)29)20(30)24-21-25-22(34-4)27-26-21/h6-12,18-19,28-29H,5H2,1-4H3,(H2,24,25,26,27,30)