3-chloranyl-N-[oxolan-2-ylmethyl(propyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[oxolan-2-ylmethyl(propyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[propyl(tetrahydrofuran-2-ylmethyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[2-oxolanylmethyl(propyl)amino]-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[oxolan-2-ylmethyl(propyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[propyl(tetrahydrofurfuryl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C18H21ClN2O2S2 MolecularWeight: 396.95454

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1CCCO1)C(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CCCN(CC1CCCO1)C(=S)NC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C18H21ClN2O2S2/c1-2-9-21(11-12-6-5-10-23-12)18(24)20-17(22)16-15(19)13-7-3-4-8-14(13)25-16/h3-4,7-8,12H,2,5-6,9-11H2,1H3,(H,20,22,24)