1-(1,3-dihydro-2-benzofuran-5-ylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea

Systemtic Name: 1-(1,3-dihydro-2-benzofuran-5-ylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea Openeye Name: 1-(1,3-dihydroisobenzofuran-5-ylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea CAS Name: 1-(1,3-dihydroisobenzofuran-5-ylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea IUPAC Name: 1-(1,3-dihydro-2-benzofuran-5-ylmethyl)-3-(6-nitro-1,3-benzothiazol-2-yl)urea Traditional Name: 1-(6-nitro-1,3-benzothiazol-2-yl)-3-(phthalan-5-ylmethyl)urea Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CO1)C=C(C=C2)CNC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C2=C(CO1)C=C(C=C2)CNC(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O4S/c22-16(18-7-10-1-2-11-8-25-9-12(11)5-10)20-17-19-14-4-3-13(21(23)24)6-15(14)26-17/h1-6H,7-9H2,(H2,18,19,20,22)