methyl 4-[[4-[ethyl(propan-2-yl)amino]phenyl]carbamothioylamino]butanoate

Systemtic Name: methyl 4-[[4-[ethyl(propan-2-yl)amino]phenyl]carbamothioylamino]butanoate Openeye Name: methyl 4-[[4-[ethyl(isopropyl)amino]phenyl]carbamothioylamino]butanoate CAS Name: 4-[[[4-[ethyl(propan-2-yl)amino]anilino]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[4-[ethyl(propan-2-yl)amino]phenyl]carbamothioylamino]butanoate Traditional Name: 4-[[4-[ethyl(isopropyl)amino]phenyl]thiocarbamoylamino]butyric acid methyl ester Formula: C17H27N3O2S MolecularWeight: 337.48018

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)NC(=S)NCCCC(=O)OC)C(C)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)NC(=S)NCCCC(=O)OC)C(C)C

InChI

InChI=1S/C17H27N3O2S/c1-5-20(13(2)3)15-10-8-14(9-11-15)19-17(23)18-12-6-7-16(21)22-4/h8-11,13H,5-7,12H2,1-4H3,(H2,18,19,23)