1-[(5-tert-butyl-2-methyl-furan-3-yl)carbonylamino]-3-(4-chloranyl-3-nitro-phenyl)thiourea

Systemtic Name: 1-[(5-tert-butyl-2-methyl-furan-3-yl)carbonylamino]-3-(4-chloranyl-3-nitro-phenyl)thiourea Openeye Name: 1-[(5-tert-butyl-2-methyl-furan-3-carbonyl)amino]-3-(4-chloro-3-nitro-phenyl)thiourea CAS Name: 1-[[(5-tert-butyl-2-methyl-3-furanyl)-oxomethyl]amino]-3-(4-chloro-3-nitrophenyl)thiourea IUPAC Name: 1-[(5-tert-butyl-2-methylfuran-3-carbonyl)amino]-3-(4-chloro-3-nitrophenyl)thiourea Traditional Name: 1-[(5-tert-butyl-2-methyl-3-furoyl)amino]-3-(4-chloro-3-nitro-phenyl)thiourea Formula: C17H19ClN4O4S MolecularWeight: 410.87516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(C)(C)C)C(=O)NNC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(O1)C(C)(C)C)C(=O)NNC(=S)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H19ClN4O4S/c1-9-11(8-14(26-9)17(2,3)4)15(23)20-21-16(27)19-10-5-6-12(18)13(7-10)22(24)25/h5-8H,1-4H3,(H,20,23)(H2,19,21,27)