N-(4-pyrrolidin-1-ylcarbonylphenyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide

Systemtic Name: N-(4-pyrrolidin-1-ylcarbonylphenyl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Openeye Name: N-[4-(pyrrolidine-1-carbonyl)phenyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide CAS Name: N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide IUPAC Name: N-[4-(pyrrolidine-1-carbonyl)phenyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Traditional Name: N-[4-(pyrrolidine-1-carbonyl)phenyl]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-2-carboxamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2=C(CC1)C=C(S2)C(=O)NC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

C1CCCC2=C(CC1)C=C(S2)C(=O)NC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C22H26N2O2S/c25-21(20-15-17-7-3-1-2-4-8-19(17)27-20)23-18-11-9-16(10-12-18)22(26)24-13-5-6-14-24/h9-12,15H,1-8,13-14H2,(H,23,25)