4-methyl-6-thiomorpholin-4-ylcarbonyl-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 4-methyl-6-thiomorpholin-4-ylcarbonyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 4-methyl-6-(thiomorpholine-4-carbonyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 4-methyl-6-[oxo(thiomorpholin-4-yl)methyl]-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 4-methyl-6-(thiomorpholine-4-carbonyl)-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 4-methyl-6-(thiomorpholine-4-carbonyl)-9H-$b-carboline-3-carboxylic acid Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3=C(C=CC(=C3)C(=O)N4CCSCC4)NC2=CN=C1C(=O)O

Isomeric SMILES

CC1=C2C3=C(C=CC(=C3)C(=O)N4CCSCC4)NC2=CN=C1C(=O)O

InChI

InChI=1S/C18H17N3O3S/c1-10-15-12-8-11(17(22)21-4-6-25-7-5-21)2-3-13(12)20-14(15)9-19-16(10)18(23)24/h2-3,8-9,20H,4-7H2,1H3,(H,23,24)