3-(3-methoxypropyl)-1-methyl-1-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]thiourea

Systemtic Name: 3-(3-methoxypropyl)-1-methyl-1-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]thiourea Openeye Name: 3-(3-methoxypropyl)-1-methyl-1-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]thiourea CAS Name: 3-(3-methoxypropyl)-1-methyl-1-[[1-oxo-3-(3-oxo-1,4-benzothiazin-4-yl)propyl]amino]thiourea IUPAC Name: 3-(3-methoxypropyl)-1-methyl-1-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]thiourea Traditional Name: 1-[3-(3-keto-1,4-benzothiazin-4-yl)propanoylamino]-3-(3-methoxypropyl)-1-methyl-thiourea Formula: C17H24N4O3S2 MolecularWeight: 396.52746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)CCN1C(=O)CSC2=CC=CC=C21

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)CCN1C(=O)CSC2=CC=CC=C21

InChI

InChI=1S/C17H24N4O3S2/c1-20(17(25)18-9-5-11-24-2)19-15(22)8-10-21-13-6-3-4-7-14(13)26-12-16(21)23/h3-4,6-7H,5,8-12H2,1-2H3,(H,18,25)(H,19,22)