1-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonylamino]-3-(2-chlorophenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonylamino]-3-(2-chlorophenyl)thiourea Openeye Name: 1-[(3-chloro-6-nitro-benzothiophene-2-carbonyl)amino]-3-(2-chlorophenyl)thiourea CAS Name: 1-[[(3-chloro-6-nitro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(2-chlorophenyl)thiourea IUPAC Name: 1-[(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)amino]-3-(2-chlorophenyl)thiourea Traditional Name: 1-[(3-chloro-6-nitro-benzothiophene-2-carbonyl)amino]-3-(2-chlorophenyl)thiourea Formula: C16H10Cl2N4O3S2 MolecularWeight: 441.3116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)Cl

InChI

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