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4-(azepan-1-ylsulfonyl)-N-[4,6-bis(fluoranyl)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]benzamide

4-(azepan-1-ylsulfonyl)-N-[4,6-bis(fluoranyl)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]benzamide

Systemtic Name:4-(azepan-1-ylsulfonyl)-N-[4,6-bis(fluoranyl)-3-prop-2-enyl-1,3-benzothiazol-2-ylidene]benzamide
Openeye Name:N-(3-allyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-4-(azepan-1-ylsulfonyl)benzamide
CAS Name:4-(1-azepanylsulfonyl)-N-(4,6-difluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
IUPAC Name:4-(azepan-1-ylsulfonyl)-N-(4,6-difluoro-3-prop-2-enyl-1,3-benzothiazol-2-ylidene)benzamide
Traditional Name:N-(3-allyl-4,6-difluoro-1,3-benzothiazol-2-ylidene)-4-(azepan-1-ylsulfonyl)benzamide
Formula: C23H23F2N3O3S2
MolecularWeight: 491.573826
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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4)F)F


Isomeric SMILES

C=CCN1C2=C(C=C(C=C2SC1=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4)F)F


InChI

InChI=1S/C23H23F2N3O3S2/c1-2-11-28-21-19(25)14-17(24)15-20(21)32-23(28)26-22(29)16-7-9-18(10-8-16)33(30,31)27-12-5-3-4-6-13-27/h2,7-10,14-15H,1,3-6,11-13H2


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