4-(2-methylprop-2-enylcarbamothioyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-(2-methylprop-2-enylcarbamothioyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-(2-methylallylcarbamothioyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[(2-methylprop-2-enylamino)-sulfanylidenemethyl]-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-(2-methylprop-2-enylcarbamothioyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-(2-methylallylthiocarbamoyl)-N-propyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CN(C2=CC=CC=C2O1)C(=S)NCC(=C)C

Isomeric SMILES

CCCNC(=O)C1CN(C2=CC=CC=C2O1)C(=S)NCC(=C)C

InChI

InChI=1S/C17H23N3O2S/c1-4-9-18-16(21)15-11-20(17(23)19-10-12(2)3)13-7-5-6-8-14(13)22-15/h5-8,15H,2,4,9-11H2,1,3H3,(H,18,21)(H,19,23)