5-[4-(2-diethylaminoethyloxy)phenyl]sulfanyl-2-nitro-aniline

Systemtic Name: 5-[4-(2-diethylaminoethyloxy)phenyl]sulfanyl-2-nitro-aniline Openeye Name: 5-[4-(2-diethylaminoethyloxy)phenyl]sulfanyl-2-nitro-aniline CAS Name: 5-[[4-(2-diethylaminoethyloxy)phenyl]thio]-2-nitroaniline IUPAC Name: 5-[4-(2-diethylaminoethyloxy)phenyl]sulfanyl-2-nitroaniline Traditional Name: 2-[4-[(3-amino-4-nitro-phenyl)thio]phenoxy]ethyl-diethyl-amine Formula: C18H23N3O3S MolecularWeight: 361.45852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)SC2=CC(=C(C=C2)[N+](=O)[O-])N

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)SC2=CC(=C(C=C2)[N+](=O)[O-])N

InChI

InChI=1S/C18H23N3O3S/c1-3-20(4-2)11-12-24-14-5-7-15(8-6-14)25-16-9-10-18(21(22)23)17(19)13-16/h5-10,13H,3-4,11-12,19H2,1-2H3