N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-1-(3,3-dimethylbutanoyl)-3-[(3-methoxyphenyl)carbamoylamino]pyrrolidine-2-carboxamide

Systemtic Name: N-[1-azanyl-3-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl]-1-(3,3-dimethylbutanoyl)-3-[(3-methoxyphenyl)carbamoylamino]pyrrolidine-2-carboxamide Openeye Name: N-[2-amino-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]-1-(3,3-dimethylbutanoyl)-3-[(3-methoxyphenyl)carbamoylamino]pyrrolidine-2-carboxamide CAS Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-(3,3-dimethyl-1-oxobutyl)-3-[[(3-methoxyanilino)-oxomethyl]amino]-2-pyrrolidinecarboxamide IUPAC Name: N-[1-amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-(3,3-dimethylbutanoyl)-3-[(3-methoxyphenyl)carbamoylamino]pyrrolidine-2-carboxamide Traditional Name: N-[2-amino-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]-1-(3,3-dimethylbutanoyl)-3-[(3-methoxyphenyl)carbamoylamino]pyrrolidine-2-carboxamide Formula: C30H38N6O5 MolecularWeight: 562.65992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCC(C1C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N)NC(=O)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)(C)CC(=O)N1CCC(C1C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N)NC(=O)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C30H38N6O5/c1-30(2,3)16-25(37)36-13-12-23(35-29(40)33-19-8-7-9-20(15-19)41-4)26(36)28(39)34-24(27(31)38)14-18-17-32-22-11-6-5-10-21(18)22/h5-11,15,17,23-24,26,32H,12-14,16H2,1-4H3,(H2,31,38)(H,34,39)(H2,33,35,40)