5-(1H-imidazol-5-ylmethyl)-9-methyl-thiopyrano[2,3-b]indol-4-one

Systemtic Name: 5-(1H-imidazol-5-ylmethyl)-9-methyl-thiopyrano[2,3-b]indol-4-one Openeye Name: 5-(1H-imidazol-5-ylmethyl)-9-methyl-thiopyrano[2,3-b]indol-4-one CAS Name: 5-(1H-imidazol-5-ylmethyl)-9-methyl-4-thiopyrano[2,3-b]indolone IUPAC Name: 5-(1H-imidazol-5-ylmethyl)-9-methylthiopyrano[2,3-b]indol-4-one Traditional Name: 5-(1H-imidazol-5-ylmethyl)-9-methyl-thiopyran[2,3-b]indol-4-one Formula: C16H13N3OS MolecularWeight: 295.35892

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC(=C2C3=C1SC=CC3=O)CC4=CN=CN4

Isomeric SMILES

CN1C2=CC=CC(=C2C3=C1SC=CC3=O)CC4=CN=CN4

InChI

InChI=1S/C16H13N3OS/c1-19-12-4-2-3-10(7-11-8-17-9-18-11)14(12)15-13(20)5-6-21-16(15)19/h2-6,8-9H,7H2,1H3,(H,17,18)