5-chloranyl-3-methyl-N-[3-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)propyl]-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-[3-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)propyl]-1H-indole-2-carboxamide Openeye Name: 5-chloro-3-methyl-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]-1H-indole-2-carboxamide CAS Name: 5-chloro-3-methyl-N-[3-[4-[oxo(thiomorpholin-4-yl)methyl]-1-triazolyl]propyl]-1H-indole-2-carboxamide IUPAC Name: 5-chloro-3-methyl-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]-1H-indole-2-carboxamide Traditional Name: 5-chloro-3-methyl-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]-1H-indole-2-carboxamide Formula: C20H23ClN6O2S MolecularWeight: 446.95362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)Cl)C(=O)NCCCN3C=C(N=N3)C(=O)N4CCSCC4

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)Cl)C(=O)NCCCN3C=C(N=N3)C(=O)N4CCSCC4

InChI

InChI=1S/C20H23ClN6O2S/c1-13-15-11-14(21)3-4-16(15)23-18(13)19(28)22-5-2-6-27-12-17(24-25-27)20(29)26-7-9-30-10-8-26/h3-4,11-12,23H,2,5-10H2,1H3,(H,22,28)