N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-chloranyl-naphthalene-1-carboxamide

Systemtic Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-chloranyl-naphthalene-1-carboxamide Openeye Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-chloro-naphthalene-1-carboxamide CAS Name: 5-chloro-N-[2-(1-oxobutylamino)-1,3-benzothiazol-6-yl]-1-naphthalenecarboxamide IUPAC Name: N-[2-(butanoylamino)-1,3-benzothiazol-6-yl]-5-chloronaphthalene-1-carboxamide Traditional Name: N-(2-butyramido-1,3-benzothiazol-6-yl)-5-chloro-1-naphthamide Formula: C22H18ClN3O2S MolecularWeight: 423.91522

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC4=C3C=CC=C4Cl

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=CC4=C3C=CC=C4Cl

InChI

InChI=1S/C22H18ClN3O2S/c1-2-5-20(27)26-22-25-18-11-10-13(12-19(18)29-22)24-21(28)16-8-3-7-15-14(16)6-4-9-17(15)23/h3-4,6-12H,2,5H2,1H3,(H,24,28)(H,25,26,27)