propan-2-yl 4-(2-dimethylaminoethylcarbamothioylamino)benzoate

Systemtic Name: propan-2-yl 4-(2-dimethylaminoethylcarbamothioylamino)benzoate Openeye Name: isopropyl 4-(2-dimethylaminoethylcarbamothioylamino)benzoate CAS Name: 4-[[(2-dimethylaminoethylamino)-sulfanylidenemethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(2-dimethylaminoethylcarbamothioylamino)benzoate Traditional Name: 4-(2-dimethylaminoethylthiocarbamoylamino)benzoic acid isopropyl ester Formula: C15H23N3O2S MolecularWeight: 309.42702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)NC(=S)NCCN(C)C

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=S)NCCN(C)C

InChI

InChI=1S/C15H23N3O2S/c1-11(2)20-14(19)12-5-7-13(8-6-12)17-15(21)16-9-10-18(3)4/h5-8,11H,9-10H2,1-4H3,(H2,16,17,21)