5-chloranyl-N-[2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]pyridin-3-yl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]pyridin-3-yl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[2-[[1-(4-pyridyl)-4-piperidyl]methylamino]-3-pyridyl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[2-[(1-pyridin-4-yl-4-piperidinyl)methylamino]-3-pyridinyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]pyridin-3-yl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[2-[[1-(4-pyridyl)-4-piperidyl]methylamino]-3-pyridyl]thiophene-2-carboxamide Formula: C21H22ClN5OS MolecularWeight: 427.95028

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=C(C=CC=N2)NC(=O)C3=CC=C(S3)Cl)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1CNC2=C(C=CC=N2)NC(=O)C3=CC=C(S3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C21H22ClN5OS/c22-19-4-3-18(29-19)21(28)26-17-2-1-9-24-20(17)25-14-15-7-12-27(13-8-15)16-5-10-23-11-6-16/h1-6,9-11,15H,7-8,12-14H2,(H,24,25)(H,26,28)