N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)cyclohexanecarboxamide

Systemtic Name: N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)cyclohexanecarboxamide Openeye Name: N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)cyclohexanecarboxamide CAS Name: N-[8-(1-pyrrolidinylsulfonyl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]cyclohexanecarboxamide IUPAC Name: N-(8-pyrrolidin-1-ylsulfonyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)cyclohexanecarboxamide Traditional Name: N-(8-pyrrolidinosulfonyl-5H-[1,2,4]triazin[5,6-b]indol-3-yl)cyclohexanecarboxamide Formula: C20H24N6O3S MolecularWeight: 428.50796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(C4=C(N3)C=CC(=C4)S(=O)(=O)N5CCCC5)N=N2

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(C4=C(N3)C=CC(=C4)S(=O)(=O)N5CCCC5)N=N2

InChI

InChI=1S/C20H24N6O3S/c27-19(13-6-2-1-3-7-13)23-20-22-18-17(24-25-20)15-12-14(8-9-16(15)21-18)30(28,29)26-10-4-5-11-26/h8-9,12-13H,1-7,10-11H2,(H2,21,22,23,25,27)