N-[[2-[(4-chlorophenyl)methyl]-2,3-dihydro-1,3-benzoxazol-5-yl]carbamothioyl]propanamide

Systemtic Name: N-[[2-[(4-chlorophenyl)methyl]-2,3-dihydro-1,3-benzoxazol-5-yl]carbamothioyl]propanamide Openeye Name: N-[[2-[(4-chlorophenyl)methyl]-2,3-dihydro-1,3-benzoxazol-5-yl]carbamothioyl]propanamide CAS Name: N-[[[2-[(4-chlorophenyl)methyl]-2,3-dihydro-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[2-[(4-chlorophenyl)methyl]-2,3-dihydro-1,3-benzoxazol-5-yl]carbamothioyl]propanamide Traditional Name: N-[[2-(4-chlorobenzyl)-2,3-dihydro-1,3-benzoxazol-5-yl]thiocarbamoyl]propionamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC2=C(C=C1)OC(N2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC2=C(C=C1)OC(N2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O2S/c1-2-16(23)22-18(25)20-13-7-8-15-14(10-13)21-17(24-15)9-11-3-5-12(19)6-4-11/h3-8,10,17,21H,2,9H2,1H3,(H2,20,22,23,25)