N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]naphthalene-2-carboxamide

Systemtic Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]naphthalene-2-carboxamide Openeye Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]naphthalene-2-carboxamide CAS Name: N-[[4-(1-pyrrolidinylmethyl)anilino]-sulfanylidenemethyl]-2-naphthalenecarboxamide IUPAC Name: N-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamothioyl]naphthalene-2-carboxamide Traditional Name: N-[[4-(pyrrolidinomethyl)phenyl]thiocarbamoyl]-2-naphthamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C23H23N3OS/c27-22(20-10-9-18-5-1-2-6-19(18)15-20)25-23(28)24-21-11-7-17(8-12-21)16-26-13-3-4-14-26/h1-2,5-12,15H,3-4,13-14,16H2,(H2,24,25,27,28)