5-(1-adamantylcarbonyl)-4-azanyl-2-phenylazanyl-thiophene-3-carbonitrile

Systemtic Name: 5-(1-adamantylcarbonyl)-4-azanyl-2-phenylazanyl-thiophene-3-carbonitrile Openeye Name: 5-(adamantane-1-carbonyl)-4-amino-2-anilino-thiophene-3-carbonitrile CAS Name: 5-[1-adamantyl(oxo)methyl]-4-amino-2-anilino-3-thiophenecarbonitrile IUPAC Name: 5-(adamantane-1-carbonyl)-4-amino-2-anilinothiophene-3-carbonitrile Traditional Name: 5-(adamantane-1-carbonyl)-4-amino-2-anilino-thiophene-3-carbonitrile Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C4=C(C(=C(S4)NC5=CC=CC=C5)C#N)N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C4=C(C(=C(S4)NC5=CC=CC=C5)C#N)N

InChI

InChI=1S/C22H23N3OS/c23-12-17-18(24)19(27-21(17)25-16-4-2-1-3-5-16)20(26)22-9-13-6-14(10-22)8-15(7-13)11-22/h1-5,13-15,25H,6-11,24H2