N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[(phenylmethyl)carbamoylamino]propanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[(phenylmethyl)carbamoylamino]propanamide Openeye Name: 3-(benzylcarbamoylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[[oxo-[(phenylmethyl)amino]methyl]amino]propanamide IUPAC Name: 3-(benzylcarbamoylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(benzylcarbamoylamino)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propionamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3S/c1-2-27-15-8-9-16-17(12-15)28-20(23-16)24-18(25)10-11-21-19(26)22-13-14-6-4-3-5-7-14/h3-9,12H,2,10-11,13H2,1H3,(H2,21,22,26)(H,23,24,25)