1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[1-(3-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[1-(3-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]urea CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[1-(3-methoxyphenyl)-5-oxo-3-pyrrolidinyl]urea IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]urea Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-[5-keto-1-(3-methoxyphenyl)pyrrolidin-3-yl]urea Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3CC(=O)N(C3)C4=CC(=CC=C4)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3CC(=O)N(C3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C21H22N4O4S/c1-3-29-16-7-8-17-18(11-16)30-21(23-17)24-20(27)22-13-9-19(26)25(12-13)14-5-4-6-15(10-14)28-2/h4-8,10-11,13H,3,9,12H2,1-2H3,(H2,22,23,24,27)