N-[1-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[1-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]amino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]carbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[1-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[1-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]carbamoyl]-3-(methylthio)propyl]benzamide Formula: C26H25N3O2S2 MolecularWeight: 475.6256

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=C(C=C1)CC2=NC3=CC=CC=C3S2)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CSCCC(C(=O)NC1=CC=C(C=C1)CC2=NC3=CC=CC=C3S2)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3O2S2/c1-32-16-15-22(29-25(30)19-7-3-2-4-8-19)26(31)27-20-13-11-18(12-14-20)17-24-28-21-9-5-6-10-23(21)33-24/h2-14,22H,15-17H2,1H3,(H,27,31)(H,29,30)