1-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-(2-chloranyl-5-nitro-phenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-3-(2-chloranyl-5-nitro-phenyl)thiourea Openeye Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(2-chloro-5-nitro-phenyl)thiourea CAS Name: 1-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(2-chloro-5-nitrophenyl)thiourea IUPAC Name: 1-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-3-(2-chloro-5-nitrophenyl)thiourea Traditional Name: 1-[(3-chlorobenzothiophene-2-carbonyl)amino]-3-(2-chloro-5-nitro-phenyl)thiourea Formula: C16H10Cl2N4O3S2 MolecularWeight: 441.3116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NNC(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NNC(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C16H10Cl2N4O3S2/c17-10-6-5-8(22(24)25)7-11(10)19-16(26)21-20-15(23)14-13(18)9-3-1-2-4-12(9)27-14/h1-7H,(H,20,23)(H2,19,21,26)