N,N'-bis[3-(2-azanyl-4-bromanyl-phenyl)sulfanylphenyl]pentanediamide

Systemtic Name: N,N'-bis[3-(2-azanyl-4-bromanyl-phenyl)sulfanylphenyl]pentanediamide Openeye Name: N,N'-bis[3-(2-amino-4-bromo-phenyl)sulfanylphenyl]pentanediamide CAS Name: N,N'-bis[3-[(2-amino-4-bromophenyl)thio]phenyl]pentanediamide IUPAC Name: N,N'-bis[3-(2-amino-4-bromophenyl)sulfanylphenyl]pentanediamide Traditional Name: N,N'-bis[3-[(2-amino-4-bromo-phenyl)thio]phenyl]glutaramide Formula: C29H26Br2N4O2S2 MolecularWeight: 686.48034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)Br)N)NC(=O)CCCC(=O)NC3=CC(=CC=C3)SC4=C(C=C(C=C4)Br)N

Isomeric SMILES

C1=CC(=CC(=C1)SC2=C(C=C(C=C2)Br)N)NC(=O)CCCC(=O)NC3=CC(=CC=C3)SC4=C(C=C(C=C4)Br)N

InChI

InChI=1S/C29H26Br2N4O2S2/c30-18-10-12-26(24(32)14-18)38-22-6-1-4-20(16-22)34-28(36)8-3-9-29(37)35-21-5-2-7-23(17-21)39-27-13-11-19(31)15-25(27)33/h1-2,4-7,10-17H,3,8-9,32-33H2,(H,34,36)(H,35,37)