1-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonylamino]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-[[(3,6-dichloro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[(3,6-dichloro-1-benzothiophene-2-carbonyl)amino]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-[(3,6-dichlorobenzothiophene-2-carbonyl)amino]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C17H12Cl2N4O4S2 MolecularWeight: 471.33758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NNC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H12Cl2N4O4S2/c1-27-12-7-9(23(25)26)3-5-11(12)20-17(28)22-21-16(24)15-14(19)10-4-2-8(18)6-13(10)29-15/h2-7H,1H3,(H,21,24)(H2,20,22,28)