3-(aminocarbonylamino)-6-(3-pyrrol-1-ylpropoxy)-[1]benzothiolo[3,2-b]furan-2-carboxamide

Systemtic Name: 3-(aminocarbonylamino)-6-(3-pyrrol-1-ylpropoxy)-[1]benzothiolo[3,2-b]furan-2-carboxamide Openeye Name: 6-(3-pyrrol-1-ylpropoxy)-3-ureido-benzothiopheno[3,2-b]furan-2-carboxamide CAS Name: 3-(carbamoylamino)-6-[3-(1-pyrrolyl)propoxy]-[1]benzothiolo[3,2-b]furan-2-carboxamide IUPAC Name: 3-(carbamoylamino)-6-(3-pyrrol-1-ylpropoxy)-[1]benzothiolo[3,2-b]furan-2-carboxamide Traditional Name: 6-(3-pyrrol-1-ylpropoxy)-3-ureido-benzothiopheno[3,2-b]furan-2-carboxamide Formula: C19H18N4O4S MolecularWeight: 398.43562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)CCCOC2=CC3=C(C=C2)C4=C(S3)C(=C(O4)C(=O)N)NC(=O)N

Isomeric SMILES

C1=CN(C=C1)CCCOC2=CC3=C(C=C2)C4=C(S3)C(=C(O4)C(=O)N)NC(=O)N

InChI

InChI=1S/C19H18N4O4S/c20-18(24)16-14(22-19(21)25)17-15(27-16)12-5-4-11(10-13(12)28-17)26-9-3-8-23-6-1-2-7-23/h1-2,4-7,10H,3,8-9H2,(H2,20,24)(H3,21,22,25)