methyl N-[(1S)-2-(1H-indol-3-yl)-1-[(phenylmethyl)carbamoylamino]ethyl]carbamate

Systemtic Name: methyl N-[(1S)-2-(1H-indol-3-yl)-1-[(phenylmethyl)carbamoylamino]ethyl]carbamate Openeye Name: methyl N-[(1S)-1-(benzylcarbamoylamino)-2-(1H-indol-3-yl)ethyl]carbamate CAS Name: N-[(1S)-2-(1H-indol-3-yl)-1-[[oxo-[(phenylmethyl)amino]methyl]amino]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[(1S)-1-(benzylcarbamoylamino)-2-(1H-indol-3-yl)ethyl]carbamate Traditional Name: N-[(1S)-1-(benzylcarbamoylamino)-2-(1H-indol-3-yl)ethyl]carbamic acid methyl ester Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(CC1=CNC2=CC=CC=C21)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3/c1-27-20(26)24-18(11-15-13-21-17-10-6-5-9-16(15)17)23-19(25)22-12-14-7-3-2-4-8-14/h2-10,13,18,21H,11-12H2,1H3,(H,24,26)(H2,22,23,25)/t18-/m0/s1