N-(3-imidazol-1-ylpropyl)-1-oxidanylidene-isothiochromene-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-1-oxidanylidene-isothiochromene-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-1-oxo-isothiochromene-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-1-oxo-2-benzothiopyran-3-carboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-1-oxoisothiochromene-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-1-keto-isothiochromene-3-carboxamide Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(SC2=O)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(SC2=O)C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C16H15N3O2S/c20-15(18-6-3-8-19-9-7-17-11-19)14-10-12-4-1-2-5-13(12)16(21)22-14/h1-2,4-5,7,9-11H,3,6,8H2,(H,18,20)