N-(2-adamantyl)-2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-(2-adamantyl)-2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-(2-adamantyl)-2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide CAS Name: N-(2-adamantyl)-2-[4-[(4-chloroanilino)-oxomethyl]phenyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-(2-adamantyl)-2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(2-adamantyl)-2-[4-[(4-chlorophenyl)carbamoyl]phenyl]-3H-benzimidazole-5-carboxamide Formula: C31H29ClN4O2 MolecularWeight: 525.04056

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)C(=O)NC7=CC=C(C=C7)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=O)C4=CC5=C(C=C4)N=C(N5)C6=CC=C(C=C6)C(=O)NC7=CC=C(C=C7)Cl

InChI

InChI=1S/C31H29ClN4O2/c32-24-6-8-25(9-7-24)33-30(37)20-3-1-19(2-4-20)29-34-26-10-5-21(16-27(26)35-29)31(38)36-28-22-12-17-11-18(14-22)15-23(28)13-17/h1-10,16-18,22-23,28H,11-15H2,(H,33,37)(H,34,35)(H,36,38)