5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[1-(phenylmethyl)piperidin-4-yl]thiophene-2-carboxamide

Systemtic Name: 5-(6-chloranyl-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[1-(phenylmethyl)piperidin-4-yl]thiophene-2-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide CAS Name: 5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)-N-[1-(phenylmethyl)-4-piperidinyl]-2-thiophenecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-5-(6-chloro-2,3-dihydro-1,4-benzoxazin-4-yl)thiophene-2-carboxamide Formula: C25H26ClN3O2S MolecularWeight: 468.01084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(S2)N3CCOC4=C3C=C(C=C4)Cl)CC5=CC=CC=C5

InChI

InChI=1S/C25H26ClN3O2S/c26-19-6-7-22-21(16-19)29(14-15-31-22)24-9-8-23(32-24)25(30)27-20-10-12-28(13-11-20)17-18-4-2-1-3-5-18/h1-9,16,20H,10-15,17H2,(H,27,30)