4-isocyanato-1,2,3,5,6,7-hexahydro-s-indacene; 4-(2-oxidanylpropan-2-yl)thiophene-2-sulfonamide

Systemtic Name: 4-isocyanato-1,2,3,5,6,7-hexahydro-s-indacene; 4-(2-oxidanylpropan-2-yl)thiophene-2-sulfonamide Openeye Name: 4-(1-hydroxy-1-methyl-ethyl)thiophene-2-sulfonamide; 4-isocyanato-1,2,3,5,6,7-hexahydro-s-indacene CAS Name: 4-(2-hydroxypropan-2-yl)-2-thiophenesulfonamide; 4-isocyanato-1,2,3,5,6,7-hexahydro-s-indacene IUPAC Name: 4-(2-hydroxypropan-2-yl)thiophene-2-sulfonamide; 4-isocyanato-1,2,3,5,6,7-hexahydro-s-indacene Traditional Name: 4-(1-hydroxy-1-methyl-ethyl)thiophene-2-sulfonamide; 4-isocyanato-1,2,3,5,6,7-hexahydro-s-indacene Formula: C20H24N2O4S2 MolecularWeight: 420.54556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CSC(=C1)S(=O)(=O)N)O.C1CC2=CC3=C(CCC3)C(=C2C1)N=C=O

Isomeric SMILES

CC(C)(C1=CSC(=C1)S(=O)(=O)N)O.C1CC2=CC3=C(CCC3)C(=C2C1)N=C=O

InChI

InChI=1S/C13H13NO.C7H11NO3S2/c15-8-14-13-11-5-1-3-9(11)7-10-4-2-6-12(10)13;1-7(2,9)5-3-6(12-4-5)13(8,10)11/h7H,1-6H2;3-4,9H,1-2H3,(H2,8,10,11)