3-bromanyl-4-(2-methoxyethoxy)-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methoxyethoxy)-N-[[1-(phenylmethyl)piperidin-4-yl]carbamothioyl]benzamide Openeye Name: N-[(1-benzyl-4-piperidyl)carbamothioyl]-3-bromo-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-4-(2-methoxyethoxy)-N-[[[1-(phenylmethyl)-4-piperidinyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(1-benzylpiperidin-4-yl)carbamothioyl]-3-bromo-4-(2-methoxyethoxy)benzamide Traditional Name: N-[(1-benzyl-4-piperidyl)thiocarbamoyl]-3-bromo-4-(2-methoxyethoxy)benzamide Formula: C23H28BrN3O3S MolecularWeight: 506.45572

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2CCN(CC2)CC3=CC=CC=C3)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2CCN(CC2)CC3=CC=CC=C3)Br

InChI

InChI=1S/C23H28BrN3O3S/c1-29-13-14-30-21-8-7-18(15-20(21)24)22(28)26-23(31)25-19-9-11-27(12-10-19)16-17-5-3-2-4-6-17/h2-8,15,19H,9-14,16H2,1H3,(H2,25,26,28,31)