ethyl 3,4-dimethyl-2-sulfanylidene-6-[3-(2-thiophen-2-ylethanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3,4-dimethyl-2-sulfanylidene-6-[3-(2-thiophen-2-ylethanoylamino)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3,4-dimethyl-6-[3-[[2-(2-thienyl)acetyl]amino]phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3,4-dimethyl-6-[3-[(1-oxo-2-thiophen-2-ylethyl)amino]phenyl]-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3,4-dimethyl-2-sulfanylidene-6-[3-[(2-thiophen-2-ylacetyl)amino]phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3,4-dimethyl-6-[3-[[2-(2-thienyl)acetyl]amino]phenyl]-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)NC1C2=CC(=CC=C2)NC(=O)CC3=CC=CS3)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)NC1C2=CC(=CC=C2)NC(=O)CC3=CC=CS3)C)C

InChI

InChI=1S/C21H23N3O3S2/c1-4-27-20(26)18-13(2)24(3)21(28)23-19(18)14-7-5-8-15(11-14)22-17(25)12-16-9-6-10-29-16/h5-11,19H,4,12H2,1-3H3,(H,22,25)(H,23,28)