N-[4-(1-adamantyl)phenyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Openeye Name: N-[4-(1-adamantyl)phenyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide CAS Name: N-[4-(1-adamantyl)phenyl]-3-methyl-1-phenyl-5-thieno[2,3-c]pyrazolecarboxamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-3-methyl-1-phenylthieno[2,3-c]pyrazole-5-carboxamide Traditional Name: N-[4-(1-adamantyl)phenyl]-3-methyl-1-phenyl-thieno[2,3-c]pyrazole-5-carboxamide Formula: C29H29N3OS MolecularWeight: 467.62506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)NC3=CC=C(C=C3)C45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

InChI

InChI=1S/C29H29N3OS/c1-18-25-14-26(34-28(25)32(31-18)24-5-3-2-4-6-24)27(33)30-23-9-7-22(8-10-23)29-15-19-11-20(16-29)13-21(12-19)17-29/h2-10,14,19-21H,11-13,15-17H2,1H3,(H,30,33)