N-(2-hept-3-ynylsulfanyl-1,3-benzothiazol-6-yl)-2-(2-phenylethenylsulfonyl)ethanamide

Systemtic Name: N-(2-hept-3-ynylsulfanyl-1,3-benzothiazol-6-yl)-2-(2-phenylethenylsulfonyl)ethanamide Openeye Name: N-(2-hept-3-ynylsulfanyl-1,3-benzothiazol-6-yl)-2-styrylsulfonyl-acetamide CAS Name: N-[2-(hept-3-ynylthio)-1,3-benzothiazol-6-yl]-2-(2-phenylethenylsulfonyl)acetamide IUPAC Name: N-(2-hept-3-ynylsulfanyl-1,3-benzothiazol-6-yl)-2-(2-phenylethenylsulfonyl)acetamide Traditional Name: N-[2-(hept-3-ynylthio)-1,3-benzothiazol-6-yl]-2-styrylsulfonyl-acetamide Formula: C24H24N2O3S3 MolecularWeight: 484.65396

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCCC#CCCSC1=NC2=C(S1)C=C(C=C2)NC(=O)CS(=O)(=O)C=CC3=CC=CC=C3

InChI

InChI=1S/C24H24N2O3S3/c1-2-3-4-5-9-15-30-24-26-21-13-12-20(17-22(21)31-24)25-23(27)18-32(28,29)16-14-19-10-7-6-8-11-19/h6-8,10-14,16-17H,2-3,9,15,18H2,1H3,(H,25,27)