(5S)-5-[[(2R)-4-phenylbutan-2-yl]iminomethyl]-1-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5S)-5-[[(2R)-4-phenylbutan-2-yl]iminomethyl]-1-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5S)-5-[[(1R)-1-methyl-3-phenyl-propyl]iminomethyl]-1-propyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5S)-5-[[(2R)-4-phenylbutan-2-yl]iminomethyl]-1-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5S)-5-[[(2R)-4-phenylbutan-2-yl]iminomethyl]-1-propyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5S)-5-[[(1R)-1-methyl-3-phenyl-propyl]iminomethyl]-1-propyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H23N3O2S MolecularWeight: 345.45912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(C(=O)NC1=S)C=NC(C)CCC2=CC=CC=C2

Isomeric SMILES

CCCN1C(=O)[C@H](C(=O)NC1=S)C=N[C@H](C)CCC2=CC=CC=C2

InChI

InChI=1S/C18H23N3O2S/c1-3-11-21-17(23)15(16(22)20-18(21)24)12-19-13(2)9-10-14-7-5-4-6-8-14/h4-8,12-13,15H,3,9-11H2,1-2H3,(H,20,22,24)/t13-,15+/m1/s1