(9-ethylcarbazol-3-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (9-ethylcarbazol-3-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (9-ethylcarbazol-3-yl)methyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (9-ethyl-3-carbazolyl)methyl ester IUPAC Name: (9-ethylcarbazol-3-yl)methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (9-ethylcarbazol-3-yl)methyl ester Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)COC(=O)C3=C(NC(=S)NC3)C)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)COC(=O)C3=C(NC(=S)NC3)C)C4=CC=CC=C41

InChI

InChI=1S/C21H21N3O2S/c1-3-24-18-7-5-4-6-15(18)16-10-14(8-9-19(16)24)12-26-20(25)17-11-22-21(27)23-13(17)2/h4-10H,3,11-12H2,1-2H3,(H2,22,23,27)