methyl 2-[4-(3-propan-2-yloxypropylcarbamothioylamino)phenyl]ethanoate

Systemtic Name: methyl 2-[4-(3-propan-2-yloxypropylcarbamothioylamino)phenyl]ethanoate Openeye Name: methyl 2-[4-(3-isopropoxypropylcarbamothioylamino)phenyl]acetate CAS Name: 2-[4-[[(3-propan-2-yloxypropylamino)-sulfanylidenemethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-(3-propan-2-yloxypropylcarbamothioylamino)phenyl]acetate Traditional Name: 2-[4-(3-isopropoxypropylthiocarbamoylamino)phenyl]acetic acid methyl ester Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=S)NC1=CC=C(C=C1)CC(=O)OC

Isomeric SMILES

CC(C)OCCCNC(=S)NC1=CC=C(C=C1)CC(=O)OC

InChI

InChI=1S/C16H24N2O3S/c1-12(2)21-10-4-9-17-16(22)18-14-7-5-13(6-8-14)11-15(19)20-3/h5-8,12H,4,9-11H2,1-3H3,(H2,17,18,22)