6-ethyl-2-[(4S,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-2-yl]-1,2,4-triazine-3,5-dione

Systemtic Name: 6-ethyl-2-[(4S,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-2-yl]-1,2,4-triazine-3,5-dione Openeye Name: 2-[(4S,5R)-4-benzyloxy-5-(benzyloxymethyl)tetrahydrothiophen-2-yl]-6-ethyl-1,2,4-triazine-3,5-dione CAS Name: 6-ethyl-2-[(4S,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)-2-thiolanyl]-1,2,4-triazine-3,5-dione IUPAC Name: 6-ethyl-2-[(4S,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-2-yl]-1,2,4-triazine-3,5-dione Traditional Name: 2-[(4S,5R)-4-benzoxy-5-(benzoxymethyl)tetrahydrothiophen-2-yl]-6-ethyl-1,2,4-triazine-3,5-quinone Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)NC1=O)C2CC(C(S2)COCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=NN(C(=O)NC1=O)C2C[C@@H]([C@H](S2)COCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O4S/c1-2-19-23(28)25-24(29)27(26-19)22-13-20(31-15-18-11-7-4-8-12-18)21(32-22)16-30-14-17-9-5-3-6-10-17/h3-12,20-22H,2,13-16H2,1H3,(H,25,28,29)/t20-,21+,22?/m0/s1