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

Systemtic Name: 3-(1H-imidazol-5-ylmethyl)-9-methyl-thiopyrano[2,3-b]indol-4-one Openeye Name: 3-(1H-imidazol-5-ylmethyl)-9-methyl-thiopyrano[2,3-b]indol-4-one CAS Name: 3-(1H-imidazol-5-ylmethyl)-9-methyl-4-thiopyrano[2,3-b]indolone IUPAC Name: 3-(1H-imidazol-5-ylmethyl)-9-methylthiopyrano[2,3-b]indol-4-one Traditional Name: 3-(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=C(C3=O)CC4=CN=CN4

Isomeric SMILES

CN1C2=CC=CC=C2C3=C1SC=C(C3=O)CC4=CN=CN4

InChI

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