3-phenethyl-2-thiophen-2-yl-thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-phenethyl-2-thiophen-2-yl-thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-phenethyl-2-(2-thienyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-phenethyl-2-thiophen-2-ylthiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-phenethyl-2-thiophen-2-ylthiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-phenethyl-2-(2-thienyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C23H16N2O2S2 MolecularWeight: 416.51534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4S3)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4S3)C5=CC=CS5

InChI

InChI=1S/C23H16N2O2S2/c26-20-16-9-4-5-10-17(16)29-22-19(20)23(27)25(13-12-15-7-2-1-3-8-15)21(24-22)18-11-6-14-28-18/h1-11,14H,12-13H2