N-[6-[2-(1-adamantyl)ethanoylamino]-1,3-benzothiazol-2-yl]butanamide

Systemtic Name: N-[6-[2-(1-adamantyl)ethanoylamino]-1,3-benzothiazol-2-yl]butanamide Openeye Name: N-[6-[[2-(1-adamantyl)acetyl]amino]-1,3-benzothiazol-2-yl]butanamide CAS Name: N-[6-[[2-(1-adamantyl)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]butanamide IUPAC Name: N-[6-[[2-(1-adamantyl)acetyl]amino]-1,3-benzothiazol-2-yl]butanamide Traditional Name: N-[6-[[2-(1-adamantyl)acetyl]amino]-1,3-benzothiazol-2-yl]butyramide Formula: C23H29N3O2S MolecularWeight: 411.56026

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N3O2S/c1-2-3-20(27)26-22-25-18-5-4-17(9-19(18)29-22)24-21(28)13-23-10-14-6-15(11-23)8-16(7-14)12-23/h4-5,9,14-16H,2-3,6-8,10-13H2,1H3,(H,24,28)(H,25,26,27)