N-butan-2-yl-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-butan-2-yl-3-(1H-indol-3-yl)-2-methyl-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 3-(1H-indol-3-yl)-2-methyl-1-oxo-N-sec-butyl-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-butan-2-yl-3-(1H-indol-3-yl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-butan-2-yl-3-(1H-indol-3-yl)-2-methyl-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 3-(1H-indol-3-yl)-1-keto-2-methyl-N-sec-butyl-3,4-dihydroisoquinoline-4-carboxamide Formula: C23H25N3O2 MolecularWeight: 375.4635

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1C(N(C(=O)C2=CC=CC=C12)C)C3=CNC4=CC=CC=C43

Isomeric SMILES

CCC(C)NC(=O)C1C(N(C(=O)C2=CC=CC=C12)C)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H25N3O2/c1-4-14(2)25-22(27)20-16-10-5-6-11-17(16)23(28)26(3)21(20)18-13-24-19-12-8-7-9-15(18)19/h5-14,20-21,24H,4H2,1-3H3,(H,25,27)