methyl 2-[3-[6-methyl-5-(phenylcarbamoyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]ethanoate

Systemtic Name: methyl 2-[3-[6-methyl-5-(phenylcarbamoyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]ethanoate Openeye Name: methyl 2-[3-[6-methyl-5-(phenylcarbamoyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]acetate CAS Name: 2-[3-[5-[anilino(oxo)methyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[6-methyl-5-(phenylcarbamoyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]acetate Traditional Name: 2-[3-[6-methyl-5-(phenylcarbamoyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-4-yl]phenoxy]acetic acid methyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=CC=C2)OCC(=O)OC)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC(=CC=C2)OCC(=O)OC)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O4S/c1-13-18(20(26)23-15-8-4-3-5-9-15)19(24-21(29)22-13)14-7-6-10-16(11-14)28-12-17(25)27-2/h3-11,19H,12H2,1-2H3,(H,23,26)(H2,22,24,29)