propan-2-yl 4-(3-methoxypropylcarbamothioylamino)benzoate

Systemtic Name: propan-2-yl 4-(3-methoxypropylcarbamothioylamino)benzoate Openeye Name: isopropyl 4-(3-methoxypropylcarbamothioylamino)benzoate CAS Name: 4-[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(3-methoxypropylcarbamothioylamino)benzoate Traditional Name: 4-(3-methoxypropylthiocarbamoylamino)benzoic acid isopropyl ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O3S/c1-11(2)20-14(18)12-5-7-13(8-6-12)17-15(21)16-9-4-10-19-3/h5-8,11H,4,9-10H2,1-3H3,(H2,16,17,21)