methyl 4-[2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(CCC2)C(=N1)SCC(=O)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=NC2=C(CCC2)C(=N1)SCC(=O)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C18H19N3O3S/c1-11-19-15-5-3-4-14(15)17(20-11)25-10-16(22)21-13-8-6-12(7-9-13)18(23)24-2/h6-9H,3-5,10H2,1-2H3,(H,21,22)