N-[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]-3,4-bis(chloranyl)benzamide

Systemtic Name: N-[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]-3,4-bis(chloranyl)benzamide Openeye Name: N-[4-(1-adamantylmethyl)thiazol-2-yl]-3,4-dichloro-benzamide CAS Name: N-[4-(1-adamantylmethyl)-2-thiazolyl]-3,4-dichlorobenzamide IUPAC Name: N-[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]-3,4-dichlorobenzamide Traditional Name: N-[4-(1-adamantylmethyl)thiazol-2-yl]-3,4-dichloro-benzamide Formula: C21H22Cl2N2OS MolecularWeight: 421.38318

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC4=CSC(=N4)NC(=O)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC4=CSC(=N4)NC(=O)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C21H22Cl2N2OS/c22-17-2-1-15(6-18(17)23)19(26)25-20-24-16(11-27-20)10-21-7-12-3-13(8-21)5-14(4-12)9-21/h1-2,6,11-14H,3-5,7-10H2,(H,24,25,26)