(2S,4S,5S,7S)-5-azanyl-N-(3-azanyl-2,2-dimethyl-3-oxidanylidene-propyl)-7-[[3-(3-methoxypropyl)-1H-indol-5-yl]methyl]-8-methyl-4-oxidanyl-2-propan-2-yl-nonanamide

Systemtic Name: (2S,4S,5S,7S)-5-azanyl-N-(3-azanyl-2,2-dimethyl-3-oxidanylidene-propyl)-7-[[3-(3-methoxypropyl)-1H-indol-5-yl]methyl]-8-methyl-4-oxidanyl-2-propan-2-yl-nonanamide Openeye Name: (2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxo-propyl)-4-hydroxy-2-isopropyl-7-[[3-(3-methoxypropyl)-1H-indol-5-yl]methyl]-8-methyl-nonanamide CAS Name: (2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[3-(3-methoxypropyl)-1H-indol-5-yl]methyl]-8-methyl-2-propan-2-ylnonanamide IUPAC Name: (2S,4S,5S,7S)-5-amino-N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-hydroxy-7-[[3-(3-methoxypropyl)-1H-indol-5-yl]methyl]-8-methyl-2-propan-2-ylnonanamide Traditional Name: (2S,4S,5S,7S)-5-amino-N-(3-amino-3-keto-2,2-dimethyl-propyl)-4-hydroxy-2-isopropyl-7-[[3-(3-methoxypropyl)-1H-indol-5-yl]methyl]-8-methyl-pelargonamide Formula: C31H52N4O4 MolecularWeight: 544.76898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC1=CC2=C(C=C1)NC=C2CCCOC)CC(C(CC(C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N

Isomeric SMILES

CC(C)[C@@H](CC1=CC2=C(C=C1)NC=C2CCCOC)C[C@@H]([C@H](C[C@@H](C(C)C)C(=O)NCC(C)(C)C(=O)N)O)N

InChI

InChI=1S/C31H52N4O4/c1-19(2)23(13-21-10-11-27-25(14-21)22(17-34-27)9-8-12-39-7)15-26(32)28(36)16-24(20(3)4)29(37)35-18-31(5,6)30(33)38/h10-11,14,17,19-20,23-24,26,28,34,36H,8-9,12-13,15-16,18,32H2,1-7H3,(H2,33,38)(H,35,37)/t23-,24-,26-,28-/m0/s1