N-[4-(3-methoxypropylcarbamothioylamino)phenyl]sulfonylbenzamide

Systemtic Name: N-[4-(3-methoxypropylcarbamothioylamino)phenyl]sulfonylbenzamide Openeye Name: N-[4-(3-methoxypropylcarbamothioylamino)phenyl]sulfonylbenzamide CAS Name: N-[4-[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]phenyl]sulfonylbenzamide IUPAC Name: N-[4-(3-methoxypropylcarbamothioylamino)phenyl]sulfonylbenzamide Traditional Name: N-[4-(3-methoxypropylthiocarbamoylamino)phenyl]sulfonylbenzamide Formula: C18H21N3O4S2 MolecularWeight: 407.50704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COCCCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H21N3O4S2/c1-25-13-5-12-19-18(26)20-15-8-10-16(11-9-15)27(23,24)21-17(22)14-6-3-2-4-7-14/h2-4,6-11H,5,12-13H2,1H3,(H,21,22)(H2,19,20,26)