N-[(2S)-1-(2-methoxyethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide

Systemtic Name: N-[(2S)-1-(2-methoxyethylamino)-3-methyl-1-oxidanylidene-butan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide Openeye Name: N-[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]-9H-pyrido[3,4-b]indole-3-carboxamide CAS Name: N-[(2S)-1-(2-methoxyethylamino)-3-methyl-1-oxobutan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide IUPAC Name: N-[(2S)-1-(2-methoxyethylamino)-3-methyl-1-oxobutan-2-yl]-9H-pyrido[3,4-b]indole-3-carboxamide Traditional Name: N-[(1S)-1-(2-methoxyethylcarbamoyl)-2-methyl-propyl]-9H-$b-carboline-3-carboxamide Formula: C20H24N4O3 MolecularWeight: 368.42956

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCOC)NC(=O)C1=NC=C2C(=C1)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCOC)NC(=O)C1=NC=C2C(=C1)C3=CC=CC=C3N2

InChI

InChI=1S/C20H24N4O3/c1-12(2)18(20(26)21-8-9-27-3)24-19(25)16-10-14-13-6-4-5-7-15(13)23-17(14)11-22-16/h4-7,10-12,18,23H,8-9H2,1-3H3,(H,21,26)(H,24,25)/t18-/m0/s1