(4R,7R)-7-azanyl-4-(2-butyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl)carbonyl-1,2,5-dithiazocan-6-one

Systemtic Name: (4R,7R)-7-azanyl-4-(2-butyl-4-naphthalen-1-ylcarbonyl-piperazin-1-yl)carbonyl-1,2,5-dithiazocan-6-one Openeye Name: (4R,7R)-7-amino-4-[2-butyl-4-(naphthalene-1-carbonyl)piperazine-1-carbonyl]-1,2,5-dithiazocan-6-one CAS Name: (4R,7R)-7-amino-4-[[2-butyl-4-[1-naphthalenyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1,2,5-dithiazocan-6-one IUPAC Name: (4R,7R)-7-amino-4-[2-butyl-4-(naphthalene-1-carbonyl)piperazine-1-carbonyl]-1,2,5-dithiazocan-6-one Traditional Name: (4R,7R)-7-amino-4-[2-butyl-4-(1-naphthoyl)piperazine-1-carbonyl]-1,2,5-dithiazocan-6-one Formula: C25H32N4O3S2 MolecularWeight: 500.67658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1C(=O)C2CSSCC(C(=O)N2)N)C(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCC1CN(CCN1C(=O)[C@@H]2CSSC[C@@H](C(=O)N2)N)C(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H32N4O3S2/c1-2-3-9-18-14-28(24(31)20-11-6-8-17-7-4-5-10-19(17)20)12-13-29(18)25(32)22-16-34-33-15-21(26)23(30)27-22/h4-8,10-11,18,21-22H,2-3,9,12-16,26H2,1H3,(H,27,30)/t18?,21-,22-/m0/s1