methyl 4-[[(4-methoxyphenyl)-[(4-propan-2-ylphenyl)methyl]carbamothioyl]amino]butanoate

Systemtic Name: methyl 4-[[(4-methoxyphenyl)-[(4-propan-2-ylphenyl)methyl]carbamothioyl]amino]butanoate Openeye Name: methyl 4-[[(4-isopropylphenyl)methyl-(4-methoxyphenyl)carbamothioyl]amino]butanoate CAS Name: 4-[[[4-methoxy-N-[(4-propan-2-ylphenyl)methyl]anilino]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[(4-methoxyphenyl)-[(4-propan-2-ylphenyl)methyl]carbamothioyl]amino]butanoate Traditional Name: 4-[[(4-isopropylbenzyl)-(4-methoxyphenyl)thiocarbamoyl]amino]butyric acid methyl ester Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)OC)C(=S)NCCCC(=O)OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN(C2=CC=C(C=C2)OC)C(=S)NCCCC(=O)OC

InChI

InChI=1S/C23H30N2O3S/c1-17(2)19-9-7-18(8-10-19)16-25(20-11-13-21(27-3)14-12-20)23(29)24-15-5-6-22(26)28-4/h7-14,17H,5-6,15-16H2,1-4H3,(H,24,29)