1-[(5-bromanylthiophen-2-yl)carbonylamino]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)carbonylamino]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-[(5-bromothiophene-2-carbonyl)amino]-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-[[(5-bromo-2-thiophenyl)-oxomethyl]amino]-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-[(5-bromothiophene-2-carbonyl)amino]-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-[(5-bromothiophene-2-carbonyl)amino]-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C13H11BrN4O4S2 MolecularWeight: 431.28484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11BrN4O4S2/c1-22-9-6-7(18(20)21)2-3-8(9)15-13(23)17-16-12(19)10-4-5-11(14)24-10/h2-6H,1H3,(H,16,19)(H2,15,17,23)