N-[6-[4-(naphthalen-2-ylamino)butanoylamino]-1,3-benzothiazol-2-yl]cyclopentanecarboxamide

Systemtic Name: N-[6-[4-(naphthalen-2-ylamino)butanoylamino]-1,3-benzothiazol-2-yl]cyclopentanecarboxamide Openeye Name: N-[6-[4-(2-naphthylamino)butanoylamino]-1,3-benzothiazol-2-yl]cyclopentanecarboxamide CAS Name: N-[6-[[4-(2-naphthalenylamino)-1-oxobutyl]amino]-1,3-benzothiazol-2-yl]cyclopentanecarboxamide IUPAC Name: N-[6-[4-(naphthalen-2-ylamino)butanoylamino]-1,3-benzothiazol-2-yl]cyclopentanecarboxamide Traditional Name: N-[6-[4-(2-naphthylamino)butanoylamino]-1,3-benzothiazol-2-yl]cyclopentanecarboxamide Formula: C27H28N4O2S MolecularWeight: 472.60182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)CCCNC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CCC(C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)NC(=O)CCCNC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H28N4O2S/c32-25(10-5-15-28-21-12-11-18-6-1-4-9-20(18)16-21)29-22-13-14-23-24(17-22)34-27(30-23)31-26(33)19-7-2-3-8-19/h1,4,6,9,11-14,16-17,19,28H,2-3,5,7-8,10,15H2,(H,29,32)(H,30,31,33)