N-[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-4-(1H-indol-3-ylcarbonyl)piperazine-1-carboxamide

Systemtic Name: N-[(2S)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-4-(1H-indol-3-ylcarbonyl)piperazine-1-carboxamide Openeye Name: N-[(1S)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]-4-(1H-indole-3-carbonyl)piperazine-1-carboxamide CAS Name: N-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-4-[1H-indol-3-yl(oxo)methyl]-1-piperazinecarboxamide IUPAC Name: N-[(2S)-1-(cyclopropylamino)-1-oxopropan-2-yl]-4-(1H-indole-3-carbonyl)piperazine-1-carboxamide Traditional Name: N-[(1S)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl]-4-(1H-indole-3-carbonyl)piperazine-1-carboxamide Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)NC(=O)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C(=O)NC1CC1)NC(=O)N2CCN(CC2)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H25N5O3/c1-13(18(26)23-14-6-7-14)22-20(28)25-10-8-24(9-11-25)19(27)16-12-21-17-5-3-2-4-15(16)17/h2-5,12-14,21H,6-11H2,1H3,(H,22,28)(H,23,26)/t13-/m0/s1