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1-adamantyl-[4-azanyl-2-[(phenylmethyl)amino]-1,3-thiazol-5-yl]methanone

1-adamantyl-[4-azanyl-2-[(phenylmethyl)amino]-1,3-thiazol-5-yl]methanone

Systemtic Name:1-adamantyl-[4-azanyl-2-[(phenylmethyl)amino]-1,3-thiazol-5-yl]methanone
Openeye Name:1-adamantyl-[4-amino-2-(benzylamino)thiazol-5-yl]methanone
CAS Name:1-adamantyl-[4-amino-2-[(phenylmethyl)amino]-5-thiazolyl]methanone
IUPAC Name:1-adamantyl-[4-amino-2-(benzylamino)-1,3-thiazol-5-yl]methanone
Traditional Name:1-adamantyl-[4-amino-2-(benzylamino)thiazol-5-yl]methanone
Formula: C21H25N3OS
MolecularWeight: 367.5077
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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C4=C(N=C(S4)NCC5=CC=CC=C5)N


Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C4=C(N=C(S4)NCC5=CC=CC=C5)N


InChI

InChI=1S/C21H25N3OS/c22-19-17(26-20(24-19)23-12-13-4-2-1-3-5-13)18(25)21-9-14-6-15(10-21)8-16(7-14)11-21/h1-5,14-16H,6-12,22H2,(H,23,24)


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