1-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea

Systemtic Name: 1-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Openeye Name: 1-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea CAS Name: 1-[4-[(5-methyl-3-isoxazolyl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea IUPAC Name: 1-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Traditional Name: 1-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]-3-(3-nitrophenyl)thiourea Formula: C17H15N5O5S2 MolecularWeight: 433.4615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O5S2/c1-11-9-16(20-27-11)21-29(25,26)15-7-5-12(6-8-15)18-17(28)19-13-3-2-4-14(10-13)22(23)24/h2-10H,1H3,(H,20,21)(H2,18,19,28)