methyl N-[(2S)-1-(5-azanylpentylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: methyl N-[(2S)-1-(5-azanylpentylamino)-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: methyl N-[(1S)-2-(5-aminopentylamino)-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-(5-aminopentylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamic acid methyl ester IUPAC Name: methyl N-[(2S)-1-(5-aminopentylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-(5-aminopentylamino)-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]carbamic acid methyl ester Formula: C18H26N4O3 MolecularWeight: 346.42404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NCCCCCN

Isomeric SMILES

COC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)NCCCCCN

InChI

InChI=1S/C18H26N4O3/c1-25-18(24)22-16(17(23)20-10-6-2-5-9-19)11-13-12-21-15-8-4-3-7-14(13)15/h3-4,7-8,12,16,21H,2,5-6,9-11,19H2,1H3,(H,20,23)(H,22,24)/t16-/m0/s1