[6-[4-azanyl-2,3-bis(methylsulfonyl)phenyl]-1-[5-azanyl-2-(3,5-dimethylphenyl)-1H-indol-3-yl]hexan-3-yl]carbamic acid

Systemtic Name: [6-[4-azanyl-2,3-bis(methylsulfonyl)phenyl]-1-[5-azanyl-2-(3,5-dimethylphenyl)-1H-indol-3-yl]hexan-3-yl]carbamic acid Openeye Name: [4-[4-amino-2,3-bis(methylsulfonyl)phenyl]-1-[2-[5-amino-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]butyl]carbamic acid CAS Name: [6-[4-amino-2,3-bis(methylsulfonyl)phenyl]-1-[5-amino-2-(3,5-dimethylphenyl)-1H-indol-3-yl]hexan-3-yl]carbamic acid IUPAC Name: [6-[4-amino-2,3-bis(methylsulfonyl)phenyl]-1-[5-amino-2-(3,5-dimethylphenyl)-1H-indol-3-yl]hexan-3-yl]carbamic acid Traditional Name: [4-(4-amino-2,3-dimesyl-phenyl)-1-[2-[5-amino-2-(3,5-dimethylphenyl)-1H-indol-3-yl]ethyl]butyl]carbamic acid Formula: C31H38N4O6S2 MolecularWeight: 626.78662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)N)CCC(CCCC4=C(C(=C(C=C4)N)S(=O)(=O)C)S(=O)(=O)C)NC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)N)CCC(CCCC4=C(C(=C(C=C4)N)S(=O)(=O)C)S(=O)(=O)C)NC(=O)O)C

InChI

InChI=1S/C31H38N4O6S2/c1-18-14-19(2)16-21(15-18)28-24(25-17-22(32)9-13-27(25)35-28)11-10-23(34-31(36)37)7-5-6-20-8-12-26(33)30(43(4,40)41)29(20)42(3,38)39/h8-9,12-17,23,34-35H,5-7,10-11,32-33H2,1-4H3,(H,36,37)