3-bromanyl-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[cyclopropylmethyl(tetrahydrofuran-2-ylmethyl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[cyclopropylmethyl(2-oxolanylmethyl)amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[cyclopropylmethyl(oxolan-2-ylmethyl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[cyclopropylmethyl(tetrahydrofurfuryl)thiocarbamoyl]-4-methoxy-benzamide Formula: C18H23BrN2O3S MolecularWeight: 427.35582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)N(CC2CC2)CC3CCCO3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)N(CC2CC2)CC3CCCO3)Br

InChI

InChI=1S/C18H23BrN2O3S/c1-23-16-7-6-13(9-15(16)19)17(22)20-18(25)21(10-12-4-5-12)11-14-3-2-8-24-14/h6-7,9,12,14H,2-5,8,10-11H2,1H3,(H,20,22,25)