1-(2-methoxyphenyl)-3-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]thiourea

Systemtic Name: 1-(2-methoxyphenyl)-3-[(5-nitro-2-oxidanylidene-indol-3-yl)amino]thiourea Openeye Name: 1-(2-methoxyphenyl)-3-[(5-nitro-2-oxo-indol-3-yl)amino]thiourea CAS Name: 1-(2-methoxyphenyl)-3-[(5-nitro-2-oxo-3-indolyl)amino]thiourea IUPAC Name: 1-(2-methoxyphenyl)-3-[(5-nitro-2-oxoindol-3-yl)amino]thiourea Traditional Name: 1-[(2-keto-5-nitro-indol-3-yl)amino]-3-(2-methoxyphenyl)thiourea Formula: C16H13N5O4S MolecularWeight: 371.37052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NNC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NNC2=C3C=C(C=CC3=NC2=O)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O4S/c1-25-13-5-3-2-4-12(13)18-16(26)20-19-14-10-8-9(21(23)24)6-7-11(10)17-15(14)22/h2-8H,1H3,(H,17,19,22)(H2,18,20,26)