[1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-(1,3-dithiolan-2-yl)benzoate

Systemtic Name: [1-(aminocarbonylamino)-3-methyl-1-oxidanylidene-butan-2-yl] 4-(1,3-dithiolan-2-yl)benzoate Openeye Name: (1-allophanoyl-2-methyl-propyl) 4-(1,3-dithiolan-2-yl)benzoate CAS Name: 4-(1,3-dithiolan-2-yl)benzoic acid [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(carbamoylamino)-3-methyl-1-oxobutan-2-yl] 4-(1,3-dithiolan-2-yl)benzoate Traditional Name: 4-(1,3-dithiolan-2-yl)benzoic acid (1-allophanoyl-2-methyl-propyl) ester Formula: C16H20N2O4S2 MolecularWeight: 368.471

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC=C(C=C1)C2SCCS2

Isomeric SMILES

CC(C)C(C(=O)NC(=O)N)OC(=O)C1=CC=C(C=C1)C2SCCS2

InChI

InChI=1S/C16H20N2O4S2/c1-9(2)12(13(19)18-16(17)21)22-14(20)10-3-5-11(6-4-10)15-23-7-8-24-15/h3-6,9,12,15H,7-8H2,1-2H3,(H3,17,18,19,21)