methyl 2-[(4-methyl-1,3-thiazol-2-yl)carbamothioylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(4-methyl-1,3-thiazol-2-yl)carbamothioylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(4-methylthiazol-2-yl)carbamothioylamino]-3-phenyl-propanoate CAS Name: 2-[[[(4-methyl-2-thiazolyl)amino]-sulfanylidenemethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(4-methyl-1,3-thiazol-2-yl)carbamothioylamino]-3-phenylpropanoate Traditional Name: 2-[(4-methylthiazol-2-yl)thiocarbamoylamino]-3-phenyl-propionic acid methyl ester Formula: C15H17N3O2S2 MolecularWeight: 335.44438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=S)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=CSC(=N1)NC(=S)NC(CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C15H17N3O2S2/c1-10-9-22-15(16-10)18-14(21)17-12(13(19)20-2)8-11-6-4-3-5-7-11/h3-7,9,12H,8H2,1-2H3,(H2,16,17,18,21)