N-[1-azanyl-3-(3-methyl-1H-indol-5-yl)-1-oxidanylidene-propan-2-yl]-2-[(2-azanyl-3-phenyl-propanoyl)-methyl-amino]-N,3-dimethyl-butanamide

Systemtic Name: N-[1-azanyl-3-(3-methyl-1H-indol-5-yl)-1-oxidanylidene-propan-2-yl]-2-[(2-azanyl-3-phenyl-propanoyl)-methyl-amino]-N,3-dimethyl-butanamide Openeye Name: N-[2-amino-1-[(3-methyl-1H-indol-5-yl)methyl]-2-oxo-ethyl]-2-[(2-amino-3-phenyl-propanoyl)-methyl-amino]-N,3-dimethyl-butanamide CAS Name: N-[1-amino-3-(3-methyl-1H-indol-5-yl)-1-oxopropan-2-yl]-2-[(2-amino-1-oxo-3-phenylpropyl)-methylamino]-N,3-dimethylbutanamide IUPAC Name: N-[1-amino-3-(3-methyl-1H-indol-5-yl)-1-oxopropan-2-yl]-2-[(2-amino-3-phenylpropanoyl)-methylamino]-N,3-dimethylbutanamide Traditional Name: N-[2-amino-2-keto-1-[(3-methyl-1H-indol-5-yl)methyl]ethyl]-N,3-dimethyl-2-[methyl(phenylalanyl)amino]butyramide Formula: C28H37N5O3 MolecularWeight: 491.62508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC2=C1C=C(C=C2)CC(C(=O)N)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CC1=CNC2=C1C=C(C=C2)CC(C(=O)N)N(C)C(=O)C(C(C)C)N(C)C(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C28H37N5O3/c1-17(2)25(33(5)27(35)22(29)14-19-9-7-6-8-10-19)28(36)32(4)24(26(30)34)15-20-11-12-23-21(13-20)18(3)16-31-23/h6-13,16-17,22,24-25,31H,14-15,29H2,1-5H3,(H2,30,34)