1-[5-(diethylamino)pentan-2-yl]-3-(4-nitrophenyl)thiourea

Systemtic Name: 1-[5-(diethylamino)pentan-2-yl]-3-(4-nitrophenyl)thiourea Openeye Name: 1-[4-(diethylamino)-1-methyl-butyl]-3-(4-nitrophenyl)thiourea CAS Name: 1-[5-(diethylamino)pentan-2-yl]-3-(4-nitrophenyl)thiourea IUPAC Name: 1-[5-(diethylamino)pentan-2-yl]-3-(4-nitrophenyl)thiourea Traditional Name: 1-[4-(diethylamino)-1-methyl-butyl]-3-(4-nitrophenyl)thiourea Formula: C16H26N4O2S MolecularWeight: 338.46824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=S)NC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCCC(C)NC(=S)NC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H26N4O2S/c1-4-19(5-2)12-6-7-13(3)17-16(23)18-14-8-10-15(11-9-14)20(21)22/h8-11,13H,4-7,12H2,1-3H3,(H2,17,18,23)