1-[(4R)-4-methyl-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-1-yl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[(4R)-4-methyl-2,5-bis(oxidanylidene)-4-phenyl-imidazolidin-1-yl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[(4R)-4-methyl-2,5-dioxo-4-phenyl-imidazolidin-1-yl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[(4R)-4-methyl-2,5-dioxo-4-phenyl-1-imidazolidinyl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[(4R)-2,5-diketo-4-methyl-4-phenyl-imidazolidin-1-yl]-3-(4-nitrophenyl)thiourea Formula: C17H15N5O4S MolecularWeight: 385.3971

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C(=O)N1)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

C[C@]1(C(=O)N(C(=O)N1)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C17H15N5O4S/c1-17(11-5-3-2-4-6-11)14(23)21(16(24)19-17)20-15(27)18-12-7-9-13(10-8-12)22(25)26/h2-10H,1H3,(H,19,24)(H2,18,20,27)/t17-/m1/s1