3-(morpholin-4-ylmethyl)-5-(3-nitro-4-phenylazanyl-phenyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-(morpholin-4-ylmethyl)-5-(3-nitro-4-phenylazanyl-phenyl)-1,3,4-oxadiazole-2-thione Openeye Name: 5-(4-anilino-3-nitro-phenyl)-3-(morpholinomethyl)-1,3,4-oxadiazole-2-thione CAS Name: 5-(4-anilino-3-nitrophenyl)-3-(4-morpholinylmethyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(4-anilino-3-nitrophenyl)-3-(morpholin-4-ylmethyl)-1,3,4-oxadiazole-2-thione Traditional Name: 5-(4-anilino-3-nitro-phenyl)-3-(morpholinomethyl)-1,3,4-oxadiazole-2-thione Formula: C19H19N5O4S MolecularWeight: 413.45026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CN2C(=S)OC(=N2)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CN2C(=S)OC(=N2)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4S/c25-24(26)17-12-14(6-7-16(17)20-15-4-2-1-3-5-15)18-21-23(19(29)28-18)13-22-8-10-27-11-9-22/h1-7,12,20H,8-11,13H2