1-adamantyl-[3-azanyl-4-(4-chlorophenyl)-2-methyl-thieno[2,3-b]pyridin-6-yl]methanone

Systemtic Name: 1-adamantyl-[3-azanyl-4-(4-chlorophenyl)-2-methyl-thieno[2,3-b]pyridin-6-yl]methanone Openeye Name: 1-adamantyl-[3-amino-4-(4-chlorophenyl)-2-methyl-thieno[2,3-b]pyridin-6-yl]methanone CAS Name: 1-adamantyl-[3-amino-4-(4-chlorophenyl)-2-methyl-6-thieno[2,3-b]pyridinyl]methanone IUPAC Name: 1-adamantyl-[3-amino-4-(4-chlorophenyl)-2-methylthieno[2,3-b]pyridin-6-yl]methanone Traditional Name: 1-adamantyl-[3-amino-4-(4-chlorophenyl)-2-methyl-thieno[2,3-b]pyridin-6-yl]methanone Formula: C25H25ClN2OS MolecularWeight: 436.9968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(C=C2C3=CC=C(C=C3)Cl)C(=O)C45CC6CC(C4)CC(C6)C5)N

Isomeric SMILES

CC1=C(C2=C(S1)N=C(C=C2C3=CC=C(C=C3)Cl)C(=O)C45CC6CC(C4)CC(C6)C5)N

InChI

InChI=1S/C25H25ClN2OS/c1-13-22(27)21-19(17-2-4-18(26)5-3-17)9-20(28-24(21)30-13)23(29)25-10-14-6-15(11-25)8-16(7-14)12-25/h2-5,9,14-16H,6-8,10-12,27H2,1H3