N-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-4-yl]-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[2,6-bis(oxidanylidene)-3-(phenylmethyl)pyrimidin-4-yl]-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(3-benzyl-2,6-dioxo-pyrimidin-4-yl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide CAS Name: N-[2,6-dioxo-3-(phenylmethyl)-4-pyrimidinyl]-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]acetamide IUPAC Name: N-(3-benzyl-2,6-dioxopyrimidin-4-yl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(3-benzyl-2,6-diketo-pyrimidin-4-yl)-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]acetamide Formula: C21H17N5O3S2 MolecularWeight: 451.52138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC(=O)NC2=O)NC(=O)CSC3=NN=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC(=O)NC2=O)NC(=O)CSC3=NN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N5O3S2/c27-17-11-16(26(20(29)23-17)12-14-7-3-1-4-8-14)22-18(28)13-30-21-25-24-19(31-21)15-9-5-2-6-10-15/h1-11H,12-13H2,(H,22,28)(H,23,27,29)