3-methoxy-N-[(3-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide

Systemtic Name: 3-methoxy-N-[(3-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide Openeye Name: 3-methoxy-N-[(3-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide CAS Name: 3-methoxy-N-[[3-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-2-naphthalenecarboxamide IUPAC Name: 3-methoxy-N-[(3-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-2-carboxamide Traditional Name: 3-methoxy-N-[(3-pyrrolidinophenyl)thiocarbamoyl]-2-naphthamide Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC=CC(=C3)N4CCCC4

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC=CC(=C3)N4CCCC4

InChI

InChI=1S/C23H23N3O2S/c1-28-21-14-17-8-3-2-7-16(17)13-20(21)22(27)25-23(29)24-18-9-6-10-19(15-18)26-11-4-5-12-26/h2-3,6-10,13-15H,4-5,11-12H2,1H3,(H2,24,25,27,29)