3-[(2S)-butan-2-yl]oxy-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-[(2S)-butan-2-yl]oxy-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-[(1S)-1-methylpropoxy]-N-[[4-(morpholinomethyl)phenyl]carbamothioyl]benzamide CAS Name: 3-[(2S)-butan-2-yl]oxy-N-[[4-(4-morpholinylmethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-[(2S)-butan-2-yl]oxy-N-[[4-(morpholin-4-ylmethyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-[(1S)-1-methylpropoxy]-N-[[4-(morpholinomethyl)phenyl]thiocarbamoyl]benzamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3

Isomeric SMILES

CC[C@H](C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)CN3CCOCC3

InChI

InChI=1S/C23H29N3O3S/c1-3-17(2)29-21-6-4-5-19(15-21)22(27)25-23(30)24-20-9-7-18(8-10-20)16-26-11-13-28-14-12-26/h4-10,15,17H,3,11-14,16H2,1-2H3,(H2,24,25,27,30)/t17-/m0/s1