2-azanyl-N-[5-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-sulfanyl-pentanoyl]-2-butyl-2-phenyl-imidazol-4-yl]-N-methyl-3-sulfanyl-propanamide

Systemtic Name: 2-azanyl-N-[5-[5-[1,3-bis(oxidanylidene)isoindol-2-yl]-5-sulfanyl-pentanoyl]-2-butyl-2-phenyl-imidazol-4-yl]-N-methyl-3-sulfanyl-propanamide Openeye Name: 2-amino-N-[2-butyl-5-[5-(1,3-dioxoisoindolin-2-yl)-5-sulfanyl-pentanoyl]-2-phenyl-imidazol-4-yl]-N-methyl-3-sulfanyl-propanamide CAS Name: 2-amino-N-[2-butyl-5-[5-(1,3-dioxo-2-isoindolyl)-5-mercapto-1-oxopentyl]-2-phenyl-4-imidazolyl]-3-mercapto-N-methylpropanamide IUPAC Name: 2-amino-N-[2-butyl-5-[5-(1,3-dioxoisoindol-2-yl)-5-sulfanylpentanoyl]-2-phenylimidazol-4-yl]-N-methyl-3-sulfanylpropanamide Traditional Name: 2-amino-N-[2-butyl-5-(5-mercapto-5-phthalimido-pentanoyl)-2-phenyl-imidazol-4-yl]-3-mercapto-N-methyl-propionamide Formula: C30H35N5O4S2 MolecularWeight: 593.76

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(N=C(C(=N1)N(C)C(=O)C(CS)N)C(=O)CCCC(N2C(=O)C3=CC=CC=C3C2=O)S)C4=CC=CC=C4

Isomeric SMILES

CCCCC1(N=C(C(=N1)N(C)C(=O)C(CS)N)C(=O)CCCC(N2C(=O)C3=CC=CC=C3C2=O)S)C4=CC=CC=C4

InChI

InChI=1S/C30H35N5O4S2/c1-3-4-17-30(19-11-6-5-7-12-19)32-25(26(33-30)34(2)29(39)22(31)18-40)23(36)15-10-16-24(41)35-27(37)20-13-8-9-14-21(20)28(35)38/h5-9,11-14,22,24,40-41H,3-4,10,15-18,31H2,1-2H3