1-ethyl-3-[6-[3-(phenylcarbamoylamino)propanoyl]-1,3-benzothiazol-2-yl]urea

Systemtic Name: 1-ethyl-3-[6-[3-(phenylcarbamoylamino)propanoyl]-1,3-benzothiazol-2-yl]urea Openeye Name: 1-ethyl-3-[6-[3-(phenylcarbamoylamino)propanoyl]-1,3-benzothiazol-2-yl]urea CAS Name: 1-[6-[3-[[anilino(oxo)methyl]amino]-1-oxopropyl]-1,3-benzothiazol-2-yl]-3-ethylurea IUPAC Name: 1-ethyl-3-[6-[3-(phenylcarbamoylamino)propanoyl]-1,3-benzothiazol-2-yl]urea Traditional Name: 1-ethyl-3-[6-[3-(phenylcarbamoylamino)propanoyl]-1,3-benzothiazol-2-yl]urea Formula: C20H21N5O3S MolecularWeight: 411.47744

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)CCNC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCNC(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)CCNC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N5O3S/c1-2-21-18(27)25-20-24-15-9-8-13(12-17(15)29-20)16(26)10-11-22-19(28)23-14-6-4-3-5-7-14/h3-9,12H,2,10-11H2,1H3,(H2,22,23,28)(H2,21,24,25,27)